NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
618859 | 5wcl | 30308 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 HT1 MET 1 9.089 -0.243 -7.616 2 H2 MET 1 HT2 MET 1 10.353 -1.308 -7.985 3 H3 MET 1 HT3 MET 1 10.190 -0.699 -6.415 4 HA MET 1 HA MET 1 8.178 -1.876 -6.067 5 HB2 MET 1 HB2 MET 1 7.290 -1.768 -8.342 6 HB3 MET 1 HB1 MET 1 8.568 -2.825 -8.923 7 HG2 MET 1 HG2 MET 1 7.639 -4.702 -7.958 8 HG3 MET 1 HG1 MET 1 6.712 -3.787 -6.787 9 HE1 MET 1 HE1 MET 1 3.913 -4.183 -7.230 10 HE2 MET 1 HE2 MET 1 5.020 -5.553 -7.273 11 HE3 MET 1 HE3 MET 1 3.779 -5.382 -8.519 12 H ASP 2 HN ASP 2 8.957 -3.176 -4.564 13 HA ASP 2 HA ASP 2 11.389 -4.576 -4.710 14 HB2 ASP 2 HB2 ASP 2 9.086 -5.498 -3.015 15 HB3 ASP 2 HB1 ASP 2 10.802 -5.608 -2.667 16 H ASP 3 HN ASP 3 11.773 -6.119 -6.200 17 HA ASP 3 HA ASP 3 9.630 -7.629 -7.284 18 HB2 ASP 3 HB2 ASP 3 11.217 -8.730 -8.655 19 HB3 ASP 3 HB1 ASP 3 11.646 -7.040 -8.555 20 H ILE 4 HN ILE 4 11.713 -8.023 -4.599 21 HA ILE 4 HA ILE 4 11.420 -10.770 -4.198 22 HB ILE 4 HB ILE 4 12.996 -9.502 -2.882 23 HG12 ILE 4 HG12 ILE 4 11.803 -11.576 -1.881 24 HG13 ILE 4 HG11 ILE 4 12.767 -10.569 -0.811 25 HG21 ILE 4 HG21 ILE 4 11.869 -7.423 -2.772 26 HG22 ILE 4 HG22 ILE 4 12.275 -7.939 -1.135 27 HG23 ILE 4 HG23 ILE 4 10.621 -8.100 -1.733 28 HD11 ILE 4 HD11 ILE 4 10.676 -9.475 -0.055 29 HD12 ILE 4 HD12 ILE 4 10.740 -11.204 0.294 30 HD13 ILE 4 HD13 ILE 4 9.767 -10.606 -1.052 31 H TYR 5 HN TYR 5 9.458 -8.040 -3.132 32 HA TYR 5 HA TYR 5 7.407 -9.695 -2.027 33 HB2 TYR 5 HB2 TYR 5 7.587 -6.737 -2.598 34 HB3 TYR 5 HB1 TYR 5 6.190 -7.492 -1.856 35 HD1 TYR 5 HD1 TYR 5 8.961 -5.641 -1.039 36 HD2 TYR 5 HD2 TYR 5 6.997 -9.229 0.074 37 HE1 TYR 5 HE1 TYR 5 9.961 -5.487 1.188 38 HE2 TYR 5 HE2 TYR 5 7.990 -9.103 2.291 39 HH TYR 5 HH TYR 5 9.687 -6.283 3.398 40 H LYS 6 HN LYS 6 8.142 -8.185 -5.009 41 HA LYS 6 HA LYS 6 5.641 -8.221 -6.294 42 HB2 LYS 6 HB2 LYS 6 7.908 -7.163 -6.922 43 HB3 LYS 6 HB1 LYS 6 8.279 -8.708 -7.666 44 HG2 LYS 6 HG2 LYS 6 6.327 -8.434 -9.116 45 HG3 LYS 6 HG1 LYS 6 6.017 -6.867 -8.387 46 HD2 LYS 6 HD2 LYS 6 7.227 -6.410 -10.364 47 HD3 LYS 6 HD1 LYS 6 8.391 -6.255 -9.040 48 HE2 LYS 6 HE2 LYS 6 9.387 -7.464 -10.880 49 HE3 LYS 6 HE1 LYS 6 9.189 -8.523 -9.489 50 HZ1 LYS 6 HZ1 LYS 6 8.570 -9.560 -11.615 51 HZ2 LYS 6 HZ2 LYS 6 7.326 -8.427 -11.796 52 HZ3 LYS 6 HZ3 LYS 6 7.290 -9.527 -10.510 53 H ALA 7 HN ALA 7 8.151 -10.602 -5.758 54 HA ALA 7 HA ALA 7 6.839 -12.825 -7.066 55 HB1 ALA 7 HB1 ALA 7 9.131 -12.491 -5.156 56 HB2 ALA 7 HB2 ALA 7 9.130 -13.123 -6.813 57 HB3 ALA 7 HB3 ALA 7 8.443 -14.083 -5.495 58 H ALA 8 HN ALA 8 6.753 -11.306 -3.943 59 HA ALA 8 HA ALA 8 5.840 -13.584 -2.549 60 HB1 ALA 8 HB1 ALA 8 5.558 -12.243 -0.690 61 HB2 ALA 8 HB2 ALA 8 5.447 -10.775 -1.667 62 HB3 ALA 8 HB3 ALA 8 6.981 -11.638 -1.532 63 H VAL 9 HN VAL 9 4.237 -10.989 -4.266 64 HA VAL 9 HA VAL 9 1.584 -11.771 -3.511 65 HB VAL 9 HB VAL 9 1.351 -9.731 -4.528 66 HG11 VAL 9 HG11 VAL 9 3.735 -9.457 -4.906 67 HG12 VAL 9 HG12 VAL 9 2.813 -8.872 -6.292 68 HG13 VAL 9 HG13 VAL 9 3.619 -10.447 -6.366 69 HG21 VAL 9 HG21 VAL 9 0.580 -9.811 -6.789 70 HG22 VAL 9 HG22 VAL 9 0.108 -11.319 -6.008 71 HG23 VAL 9 HG23 VAL 9 1.489 -11.292 -7.099 72 H GLU 10 HN GLU 10 3.919 -12.772 -5.903 73 HA GLU 10 HA GLU 10 2.195 -14.486 -7.316 74 HB2 GLU 10 HB2 GLU 10 5.126 -15.010 -7.125 75 HB3 GLU 10 HB1 GLU 10 4.052 -15.197 -8.514 76 HG2 GLU 10 HG2 GLU 10 3.844 -12.690 -8.439 77 HG3 GLU 10 HG1 GLU 10 5.131 -12.728 -7.315 78 H GLN 11 HN GLN 11 3.658 -14.447 -4.393 79 HA GLN 11 HA GLN 11 3.770 -17.303 -3.846 80 HB2 GLN 11 HB2 GLN 11 5.737 -16.048 -3.387 81 HB3 GLN 11 HB1 GLN 11 4.832 -14.863 -2.529 82 HG2 GLN 11 HG2 GLN 11 6.113 -16.264 -1.089 83 HG3 GLN 11 HG1 GLN 11 4.404 -16.391 -0.806 84 HE21 GLN 11 HE21 GLN 11 3.354 -18.356 -1.259 85 HE22 GLN 11 HE22 GLN 11 4.238 -19.813 -1.567 86 H LEU 12 HN LEU 12 1.861 -14.461 -3.173 87 HA LEU 12 HA LEU 12 0.680 -15.406 -0.768 88 HB2 LEU 12 HB2 LEU 12 -0.466 -13.372 -2.663 89 HB3 LEU 12 HB1 LEU 12 -0.978 -13.685 -1.076 90 HG LEU 12 HG LEU 12 1.789 -12.704 -1.562 91 HD11 LEU 12 HD11 LEU 12 0.985 -10.458 -1.307 92 HD12 LEU 12 HD12 LEU 12 -0.654 -11.025 -1.015 93 HD13 LEU 12 HD13 LEU 12 0.051 -11.202 -2.604 94 HD21 LEU 12 HD21 LEU 12 -0.127 -12.719 0.776 95 HD22 LEU 12 HD22 LEU 12 1.451 -11.918 0.776 96 HD23 LEU 12 HD23 LEU 12 1.345 -13.669 0.607 97 H THR 13 HN THR 13 -1.391 -16.283 -0.481 98 HA THR 13 HA THR 13 -2.259 -18.056 -2.529 99 HB THR 13 HB THR 13 -4.115 -18.594 -1.026 100 HG1 THR 13 HG1 THR 13 -3.812 -17.401 1.147 101 HG21 THR 13 HG21 THR 13 -2.829 -19.379 0.894 102 HG22 THR 13 HG22 THR 13 -1.517 -18.276 0.473 103 HG23 THR 13 HG23 THR 13 -1.921 -19.624 -0.599 104 H GLU 14 HN GLU 14 -4.635 -18.059 -3.163 105 HA GLU 14 HA GLU 14 -5.277 -15.817 -4.651 106 HB2 GLU 14 HB2 GLU 14 -6.399 -17.672 -5.365 107 HB3 GLU 14 HB1 GLU 14 -6.743 -18.228 -3.734 108 HG2 GLU 14 HG2 GLU 14 -8.519 -16.772 -3.504 109 HG3 GLU 14 HG1 GLU 14 -8.008 -15.815 -4.873 110 H GLU 15 HN GLU 15 -6.761 -16.898 -1.633 111 HA GLU 15 HA GLU 15 -8.337 -14.723 -1.041 112 HB2 GLU 15 HB2 GLU 15 -6.736 -16.120 1.105 113 HB3 GLU 15 HB1 GLU 15 -8.314 -15.367 1.245 114 HG2 GLU 15 HG2 GLU 15 -8.843 -17.598 1.248 115 HG3 GLU 15 HG1 GLU 15 -9.067 -17.163 -0.444 116 H GLN 16 HN GLN 16 -4.868 -15.084 -0.451 117 HA GLN 16 HA GLN 16 -4.473 -12.875 1.132 118 HB2 GLN 16 HB2 GLN 16 -2.685 -14.286 -0.778 119 HB3 GLN 16 HB1 GLN 16 -2.121 -12.968 0.209 120 HG2 GLN 16 HG2 GLN 16 -3.141 -15.602 1.018 121 HG3 GLN 16 HG1 GLN 16 -1.617 -14.879 1.432 122 HE21 GLN 16 HE21 GLN 16 -1.741 -12.991 2.920 123 HE22 GLN 16 HE22 GLN 16 -3.021 -12.939 4.077 124 H LYS 17 HN LYS 17 -4.146 -13.031 -2.365 125 HA LYS 17 HA LYS 17 -3.606 -10.244 -2.536 126 HB2 LYS 17 HB2 LYS 17 -4.448 -12.120 -4.745 127 HB3 LYS 17 HB1 LYS 17 -3.517 -10.636 -4.895 128 HG2 LYS 17 HG2 LYS 17 -1.604 -11.592 -3.978 129 HG3 LYS 17 HG1 LYS 17 -2.504 -12.949 -3.289 130 HD2 LYS 17 HD2 LYS 17 -1.169 -13.477 -5.355 131 HD3 LYS 17 HD1 LYS 17 -2.891 -13.886 -5.423 132 HE2 LYS 17 HE2 LYS 17 -3.287 -11.674 -6.496 133 HE3 LYS 17 HE1 LYS 17 -1.556 -11.483 -6.612 134 HZ1 LYS 17 HZ1 LYS 17 -3.080 -13.724 -7.825 135 HZ2 LYS 17 HZ2 LYS 17 -1.416 -13.451 -7.979 136 HZ3 LYS 17 HZ3 LYS 17 -2.514 -12.371 -8.667 137 H ASN 18 HN ASN 18 -6.454 -12.243 -2.698 138 HA ASN 18 HA ASN 18 -8.240 -10.490 -3.989 139 HB2 ASN 18 HB2 ASN 18 -8.570 -12.978 -3.463 140 HB3 ASN 18 HB1 ASN 18 -8.940 -12.489 -1.818 141 HD21 ASN 18 HD21 ASN 18 -10.562 -13.848 -3.819 142 HD22 ASN 18 HD22 ASN 18 -11.993 -12.892 -4.006 143 H GLU 19 HN GLU 19 -7.532 -10.996 -0.559 144 HA GLU 19 HA GLU 19 -9.348 -9.149 0.499 145 HB2 GLU 19 HB2 GLU 19 -7.941 -10.924 1.691 146 HB3 GLU 19 HB1 GLU 19 -6.680 -9.719 1.696 147 HG2 GLU 19 HG2 GLU 19 -7.793 -8.327 3.127 148 HG3 GLU 19 HG1 GLU 19 -9.358 -9.040 2.751 149 H PHE 20 HN PHE 20 -5.958 -8.864 -0.201 150 HA PHE 20 HA PHE 20 -5.546 -6.248 0.583 151 HB2 PHE 20 HB2 PHE 20 -4.156 -7.714 -1.657 152 HB3 PHE 20 HB1 PHE 20 -3.535 -6.328 -0.785 153 HD1 PHE 20 HD1 PHE 20 -4.947 -7.878 1.820 154 HD2 PHE 20 HD2 PHE 20 -1.880 -8.598 -0.998 155 HE1 PHE 20 HE1 PHE 20 -3.911 -9.495 3.362 156 HE2 PHE 20 HE2 PHE 20 -0.831 -10.198 0.503 157 HZ PHE 20 HZ PHE 20 -1.848 -10.687 2.691 158 H LYS 21 HN LYS 21 -6.492 -7.520 -2.571 159 HA LYS 21 HA LYS 21 -6.534 -5.281 -4.159 160 HB2 LYS 21 HB2 LYS 21 -7.268 -7.707 -4.634 161 HB3 LYS 21 HB1 LYS 21 -8.823 -7.192 -4.064 162 HG2 LYS 21 HG2 LYS 21 -7.374 -6.378 -6.530 163 HG3 LYS 21 HG1 LYS 21 -8.988 -7.034 -6.358 164 HD2 LYS 21 HD2 LYS 21 -8.289 -4.300 -5.365 165 HD3 LYS 21 HD1 LYS 21 -8.793 -4.609 -7.027 166 HE2 LYS 21 HE2 LYS 21 -10.351 -4.971 -4.491 167 HE3 LYS 21 HE1 LYS 21 -10.767 -4.056 -5.926 168 HZ1 LYS 21 HZ1 LYS 21 -10.964 -6.179 -7.132 169 HZ2 LYS 21 HZ2 LYS 21 -12.087 -6.015 -5.887 170 HZ3 LYS 21 HZ3 LYS 21 -10.738 -7.007 -5.676 171 H ALA 22 HN ALA 22 -9.078 -6.368 -1.936 172 HA ALA 22 HA ALA 22 -10.975 -4.485 -2.521 173 HB1 ALA 22 HB1 ALA 22 -10.378 -5.573 0.223 174 HB2 ALA 22 HB2 ALA 22 -11.301 -6.420 -1.021 175 HB3 ALA 22 HB3 ALA 22 -11.914 -4.912 -0.338 176 H ALA 23 HN ALA 23 -8.293 -4.252 -0.216 177 HA ALA 23 HA ALA 23 -8.941 -1.740 0.855 178 HB1 ALA 23 HB1 ALA 23 -6.313 -3.190 0.586 179 HB2 ALA 23 HB2 ALA 23 -7.353 -3.088 2.004 180 HB3 ALA 23 HB3 ALA 23 -6.482 -1.661 1.442 181 H PHE 24 HN PHE 24 -6.927 -2.641 -1.934 182 HA PHE 24 HA PHE 24 -6.098 -0.143 -2.800 183 HB2 PHE 24 HB2 PHE 24 -5.399 -2.162 -3.922 184 HB3 PHE 24 HB1 PHE 24 -7.032 -2.523 -4.347 185 HD1 PHE 24 HD1 PHE 24 -7.320 -2.452 -6.593 186 HD2 PHE 24 HD2 PHE 24 -4.975 0.573 -4.744 187 HE1 PHE 24 HE1 PHE 24 -7.103 -1.304 -8.749 188 HE2 PHE 24 HE2 PHE 24 -4.755 1.723 -6.896 189 HZ PHE 24 HZ PHE 24 -5.818 0.784 -8.905 190 H ASP 25 HN ASP 25 -8.851 -1.943 -3.844 191 HA ASP 25 HA ASP 25 -10.189 -0.137 -5.436 192 HB2 ASP 25 HB2 ASP 25 -10.699 -2.598 -4.947 193 HB3 ASP 25 HB1 ASP 25 -11.653 -2.006 -3.618 194 H ILE 26 HN ILE 26 -10.346 -0.373 -1.941 195 HA ILE 26 HA ILE 26 -12.483 1.595 -1.756 196 HB ILE 26 HB ILE 26 -10.894 0.148 0.325 197 HG12 ILE 26 HG12 ILE 26 -13.706 -0.435 -0.493 198 HG13 ILE 26 HG11 ILE 26 -12.348 -1.113 -1.349 199 HG21 ILE 26 HG21 ILE 26 -12.395 0.879 1.950 200 HG22 ILE 26 HG22 ILE 26 -13.582 1.372 0.748 201 HG23 ILE 26 HG23 ILE 26 -12.104 2.320 0.969 202 HD11 ILE 26 HD11 ILE 26 -11.619 -2.274 0.610 203 HD12 ILE 26 HD12 ILE 26 -13.307 -2.653 0.278 204 HD13 ILE 26 HD13 ILE 26 -12.898 -1.520 1.567 205 H PHE 27 HN PHE 27 -9.052 1.320 -1.447 206 HA PHE 27 HA PHE 27 -8.416 3.803 -0.314 207 HB2 PHE 27 HB2 PHE 27 -7.111 1.698 -1.785 208 HB3 PHE 27 HB1 PHE 27 -6.584 3.254 -2.370 209 HD1 PHE 27 HD1 PHE 27 -5.286 4.740 -0.992 210 HD2 PHE 27 HD2 PHE 27 -6.665 0.986 0.412 211 HE1 PHE 27 HE1 PHE 27 -3.718 4.880 0.897 212 HE2 PHE 27 HE2 PHE 27 -5.102 1.117 2.300 213 HZ PHE 27 HZ PHE 27 -3.651 3.060 2.543 214 H VAL 28 HN VAL 28 -9.690 2.818 -3.330 215 HA VAL 28 HA VAL 28 -9.321 5.510 -4.450 216 HB VAL 28 HB VAL 28 -9.673 4.473 -6.692 217 HG11 VAL 28 HG11 VAL 28 -7.434 4.937 -5.622 218 HG12 VAL 28 HG12 VAL 28 -7.453 3.746 -6.930 219 HG13 VAL 28 HG13 VAL 28 -7.372 3.210 -5.246 220 HG21 VAL 28 HG21 VAL 28 -9.614 2.125 -6.984 221 HG22 VAL 28 HG22 VAL 28 -10.834 2.444 -5.747 222 HG23 VAL 28 HG23 VAL 28 -9.236 1.860 -5.282 223 H LEU 29 HN LEU 29 -11.461 4.766 -2.645 224 HA LEU 29 HA LEU 29 -13.861 4.127 -3.898 225 HB2 LEU 29 HB2 LEU 29 -13.300 5.837 -1.490 226 HB3 LEU 29 HB1 LEU 29 -14.931 5.467 -2.011 227 HG LEU 29 HG LEU 29 -12.873 3.410 -1.214 228 HD11 LEU 29 HD11 LEU 29 -14.103 3.155 0.840 229 HD12 LEU 29 HD12 LEU 29 -15.254 4.400 0.346 230 HD13 LEU 29 HD13 LEU 29 -13.576 4.831 0.676 231 HD21 LEU 29 HD21 LEU 29 -14.470 2.501 -2.771 232 HD22 LEU 29 HD22 LEU 29 -15.810 3.190 -1.856 233 HD23 LEU 29 HD23 LEU 29 -14.834 1.904 -1.152 234 H GLY 30 HN GLY 30 -14.794 5.064 -5.548 235 HA2 GLY 30 HA2 GLY 30 -15.868 6.699 -6.754 236 HA3 GLY 30 HA1 GLY 30 -15.433 7.852 -5.508 237 H ALA 31 HN ALA 31 -12.686 6.200 -6.618 238 HA ALA 31 HA ALA 31 -11.608 8.546 -7.836 239 HB1 ALA 31 HB1 ALA 31 -10.104 7.009 -6.748 240 HB2 ALA 31 HB2 ALA 31 -9.700 7.056 -8.467 241 HB3 ALA 31 HB3 ALA 31 -10.610 5.699 -7.815 242 H GLU 32 HN GLU 32 -11.403 9.111 -9.920 243 HA GLU 32 HA GLU 32 -13.140 7.988 -11.837 244 HB2 GLU 32 HB2 GLU 32 -10.881 9.956 -12.080 245 HB3 GLU 32 HB1 GLU 32 -11.894 9.485 -13.439 246 HG2 GLU 32 HG2 GLU 32 -12.906 10.705 -10.891 247 HG3 GLU 32 HG1 GLU 32 -12.596 11.595 -12.382 248 H ASP 33 HN ASP 33 -9.587 7.814 -11.457 249 HA ASP 33 HA ASP 33 -9.455 5.975 -13.697 250 HB2 ASP 33 HB2 ASP 33 -7.700 7.773 -13.272 251 HB3 ASP 33 HB1 ASP 33 -7.166 6.757 -11.948 252 H GLY 34 HN GLY 34 -9.617 5.893 -10.293 253 HA2 GLY 34 HA2 GLY 34 -9.950 4.111 -8.881 254 HA3 GLY 34 HA1 GLY 34 -9.941 3.064 -10.282 255 H SER 35 HN SER 35 -7.249 5.052 -10.109 256 HA SER 35 HA SER 35 -5.645 2.951 -8.816 257 HB2 SER 35 HB2 SER 35 -3.708 4.233 -9.912 258 HB3 SER 35 HB1 SER 35 -4.724 3.289 -10.977 259 HG SER 35 HG SER 35 -5.396 5.034 -11.937 260 H ILE 36 HN ILE 36 -4.176 3.668 -7.185 261 HA ILE 36 HA ILE 36 -5.330 5.720 -5.530 262 HB ILE 36 HB ILE 36 -2.923 3.907 -5.235 263 HG12 ILE 36 HG12 ILE 36 -5.351 4.098 -3.484 264 HG13 ILE 36 HG11 ILE 36 -5.305 3.069 -4.918 265 HG21 ILE 36 HG21 ILE 36 -2.406 6.066 -4.154 266 HG22 ILE 36 HG22 ILE 36 -2.525 4.734 -3.005 267 HG23 ILE 36 HG23 ILE 36 -3.851 5.888 -3.159 268 HD11 ILE 36 HD11 ILE 36 -3.532 2.882 -2.502 269 HD12 ILE 36 HD12 ILE 36 -3.371 1.889 -3.951 270 HD13 ILE 36 HD13 ILE 36 -4.823 1.772 -2.956 271 H SER 37 HN SER 37 -4.982 7.765 -6.247 272 HA SER 37 HA SER 37 -2.308 8.594 -6.974 273 HB2 SER 37 HB2 SER 37 -3.234 10.794 -7.290 274 HB3 SER 37 HB1 SER 37 -4.372 9.641 -7.985 275 HG SER 37 HG SER 37 -5.829 10.240 -6.563 276 H THR 38 HN THR 38 -1.773 10.815 -5.634 277 HA THR 38 HA THR 38 -0.978 9.713 -3.191 278 HB THR 38 HB THR 38 -0.297 12.153 -2.705 279 HG1 THR 38 HG1 THR 38 -0.414 12.501 -5.476 280 HG21 THR 38 HG21 THR 38 1.656 11.799 -4.160 281 HG22 THR 38 HG22 THR 38 0.768 10.551 -5.037 282 HG23 THR 38 HG23 THR 38 1.184 10.311 -3.335 283 H LYS 39 HN LYS 39 -3.606 12.001 -3.932 284 HA LYS 39 HA LYS 39 -4.141 12.179 -1.115 285 HB2 LYS 39 HB2 LYS 39 -4.645 13.970 -2.885 286 HB3 LYS 39 HB1 LYS 39 -6.140 13.072 -3.071 287 HG2 LYS 39 HG2 LYS 39 -5.944 15.028 -1.380 288 HG3 LYS 39 HG1 LYS 39 -6.906 13.613 -0.993 289 HD2 LYS 39 HD2 LYS 39 -5.100 12.732 0.339 290 HD3 LYS 39 HD1 LYS 39 -4.040 14.054 -0.160 291 HE2 LYS 39 HE2 LYS 39 -6.595 14.351 1.410 292 HE3 LYS 39 HE1 LYS 39 -4.972 14.353 2.105 293 HZ1 LYS 39 HZ1 LYS 39 -5.999 16.307 0.113 294 HZ2 LYS 39 HZ2 LYS 39 -4.457 16.329 0.800 295 HZ3 LYS 39 HZ3 LYS 39 -5.818 16.613 1.764 296 H GLU 40 HN GLU 40 -5.349 10.226 -3.781 297 HA GLU 40 HA GLU 40 -7.460 8.941 -2.473 298 HB2 GLU 40 HB2 GLU 40 -5.474 8.117 -4.550 299 HB3 GLU 40 HB1 GLU 40 -6.361 6.840 -3.737 300 HG2 GLU 40 HG2 GLU 40 -7.348 7.555 -5.882 301 HG3 GLU 40 HG1 GLU 40 -8.443 7.677 -4.517 302 H LEU 41 HN LEU 41 -4.006 8.271 -2.435 303 HA LEU 41 HA LEU 41 -3.956 6.267 -0.472 304 HB2 LEU 41 HB2 LEU 41 -2.108 6.742 -1.978 305 HB3 LEU 41 HB1 LEU 41 -1.914 8.331 -1.286 306 HG LEU 41 HG LEU 41 -1.103 7.372 0.783 307 HD11 LEU 41 HD11 LEU 41 -0.483 4.775 0.330 308 HD12 LEU 41 HD12 LEU 41 -2.068 4.893 -0.444 309 HD13 LEU 41 HD13 LEU 41 -1.874 5.322 1.247 310 HD21 LEU 41 HD21 LEU 41 0.328 7.884 -1.243 311 HD22 LEU 41 HD22 LEU 41 0.350 6.148 -1.558 312 HD23 LEU 41 HD23 LEU 41 1.038 6.786 -0.062 313 H GLY 42 HN GLY 42 -3.649 9.793 -0.259 314 HA2 GLY 42 HA2 GLY 42 -3.056 10.046 2.458 315 HA3 GLY 42 HA1 GLY 42 -3.758 11.298 1.458 316 H LYS 43 HN LYS 43 -6.137 9.981 0.764 317 HA LYS 43 HA LYS 43 -7.968 10.585 2.703 318 HB2 LYS 43 HB2 LYS 43 -8.730 10.090 0.531 319 HB3 LYS 43 HB1 LYS 43 -7.946 8.515 0.522 320 HG2 LYS 43 HG2 LYS 43 -9.666 8.245 2.603 321 HG3 LYS 43 HG1 LYS 43 -10.563 9.321 1.525 322 HD2 LYS 43 HD2 LYS 43 -10.194 7.753 -0.331 323 HD3 LYS 43 HD1 LYS 43 -9.324 6.676 0.759 324 HE2 LYS 43 HE2 LYS 43 -11.539 5.825 0.501 325 HE3 LYS 43 HE1 LYS 43 -11.400 6.494 2.124 326 HZ1 LYS 43 HZ1 LYS 43 -13.487 7.078 0.981 327 HZ2 LYS 43 HZ2 LYS 43 -12.590 7.928 -0.177 328 HZ3 LYS 43 HZ3 LYS 43 -12.582 8.433 1.435 329 H VAL 44 HN VAL 44 -6.640 7.378 2.071 330 HA VAL 44 HA VAL 44 -7.958 6.103 4.201 331 HB VAL 44 HB VAL 44 -5.523 5.350 2.615 332 HG11 VAL 44 HG11 VAL 44 -6.959 3.697 4.727 333 HG12 VAL 44 HG12 VAL 44 -5.308 4.309 4.854 334 HG13 VAL 44 HG13 VAL 44 -5.708 3.093 3.637 335 HG21 VAL 44 HG21 VAL 44 -8.374 4.406 2.736 336 HG22 VAL 44 HG22 VAL 44 -7.120 3.702 1.697 337 HG23 VAL 44 HG23 VAL 44 -7.650 5.368 1.443 338 H MET 45 HN MET 45 -4.784 7.533 3.887 339 HA MET 45 HA MET 45 -3.732 6.706 6.343 340 HB2 MET 45 HB2 MET 45 -3.227 9.302 4.898 341 HB3 MET 45 HB1 MET 45 -2.169 8.508 6.056 342 HG2 MET 45 HG2 MET 45 -2.921 6.851 3.787 343 HG3 MET 45 HG1 MET 45 -1.966 8.269 3.366 344 HE1 MET 45 HE1 MET 45 -0.176 8.517 6.020 345 HE2 MET 45 HE2 MET 45 0.314 8.733 4.336 346 HE3 MET 45 HE3 MET 45 1.232 7.661 5.391 347 H ARG 46 HN ARG 46 -5.662 9.607 5.464 348 HA ARG 46 HA ARG 46 -5.806 10.579 8.128 349 HB2 ARG 46 HB2 ARG 46 -7.064 11.223 5.541 350 HB3 ARG 46 HB1 ARG 46 -7.930 11.720 6.975 351 HG2 ARG 46 HG2 ARG 46 -6.584 13.571 6.663 352 HG3 ARG 46 HG1 ARG 46 -5.553 12.604 7.684 353 HD2 ARG 46 HD2 ARG 46 -4.193 12.016 6.009 354 HD3 ARG 46 HD1 ARG 46 -5.385 12.170 4.764 355 HE ARG 46 HE ARG 46 -3.544 14.154 5.549 356 HH11 ARG 46 HH11 ARG 46 -6.865 13.732 4.542 357 HH12 ARG 46 HH12 ARG 46 -7.071 15.382 4.054 358 HH21 ARG 46 HH21 ARG 46 -3.784 16.324 4.860 359 HH22 ARG 46 HH22 ARG 46 -5.306 16.861 4.228 360 H MET 47 HN MET 47 -7.653 8.280 6.275 361 HA MET 47 HA MET 47 -9.801 7.864 8.006 362 HB2 MET 47 HB2 MET 47 -8.339 6.316 5.941 363 HB3 MET 47 HB1 MET 47 -9.525 5.507 6.885 364 HG2 MET 47 HG2 MET 47 -11.244 7.005 6.109 365 HG3 MET 47 HG1 MET 47 -10.038 7.934 5.230 366 HE1 MET 47 HE1 MET 47 -10.375 4.002 5.578 367 HE2 MET 47 HE2 MET 47 -11.328 3.637 4.143 368 HE3 MET 47 HE3 MET 47 -12.036 4.580 5.453 369 H LEU 48 HN LEU 48 -6.454 7.192 8.262 370 HA LEU 48 HA LEU 48 -6.828 5.189 10.366 371 HB2 LEU 48 HB2 LEU 48 -4.337 6.025 8.965 372 HB3 LEU 48 HB1 LEU 48 -4.476 4.700 10.084 373 HG LEU 48 HG LEU 48 -5.752 4.891 7.371 374 HD11 LEU 48 HD11 LEU 48 -3.338 4.468 7.375 375 HD12 LEU 48 HD12 LEU 48 -4.254 3.076 6.801 376 HD13 LEU 48 HD13 LEU 48 -3.590 3.081 8.435 377 HD21 LEU 48 HD21 LEU 48 -5.902 2.710 9.452 378 HD22 LEU 48 HD22 LEU 48 -6.493 2.586 7.798 379 HD23 LEU 48 HD23 LEU 48 -7.235 3.737 8.905 380 H GLY 49 HN GLY 49 -6.586 8.443 10.192 381 HA2 GLY 49 HA2 GLY 49 -6.251 9.856 12.060 382 HA3 GLY 49 HA1 GLY 49 -5.292 8.590 12.809 383 H GLN 50 HN GLN 50 -4.187 8.687 9.761 384 HA GLN 50 HA GLN 50 -1.877 10.279 10.384 385 HB2 GLN 50 HB2 GLN 50 -2.776 9.003 7.807 386 HB3 GLN 50 HB1 GLN 50 -1.206 9.745 8.045 387 HG2 GLN 50 HG2 GLN 50 -2.301 7.268 9.364 388 HG3 GLN 50 HG1 GLN 50 -1.001 7.352 8.181 389 HE21 GLN 50 HE21 GLN 50 -1.894 7.725 11.494 390 HE22 GLN 50 HE22 GLN 50 -0.294 7.925 12.114 391 H ASN 51 HN ASN 51 -1.202 12.131 9.057 392 HA ASN 51 HA ASN 51 -3.156 13.159 7.188 393 HB2 ASN 51 HB2 ASN 51 -3.939 14.387 9.000 394 HB3 ASN 51 HB1 ASN 51 -2.340 14.675 9.610 395 HD21 ASN 51 HD21 ASN 51 -2.668 16.901 9.729 396 HD22 ASN 51 HD22 ASN 51 -2.709 17.890 8.314 397 HA PRO 52 HA PRO 52 1.216 13.122 5.514 398 HB2 PRO 52 HB2 PRO 52 0.086 12.484 3.075 399 HB3 PRO 52 HB1 PRO 52 0.829 11.353 4.167 400 HG2 PRO 52 HG2 PRO 52 -2.023 11.953 3.699 401 HG3 PRO 52 HG1 PRO 52 -1.264 10.415 4.141 402 HD2 PRO 52 HD2 PRO 52 -2.613 11.878 5.898 403 HD3 PRO 52 HD1 PRO 52 -1.236 10.946 6.369 404 H THR 53 HN THR 53 2.035 14.330 3.818 405 HA THR 53 HA THR 53 0.109 15.965 2.347 406 HB THR 53 HB THR 53 2.117 17.391 1.731 407 HG1 THR 53 HG1 THR 53 3.259 15.788 3.805 408 HG21 THR 53 HG21 THR 53 0.481 18.159 3.379 409 HG22 THR 53 HG22 THR 53 2.111 18.661 3.831 410 HG23 THR 53 HG23 THR 53 1.349 17.300 4.652 411 HA PRO 54 HA PRO 54 0.586 13.657 -1.292 412 HB2 PRO 54 HB2 PRO 54 1.552 16.210 -2.449 413 HB3 PRO 54 HB1 PRO 54 0.448 15.024 -3.139 414 HG2 PRO 54 HG2 PRO 54 -0.497 17.177 -1.982 415 HG3 PRO 54 HG1 PRO 54 -1.255 15.625 -1.707 416 HD2 PRO 54 HD2 PRO 54 0.416 17.264 0.101 417 HD3 PRO 54 HD1 PRO 54 -0.893 16.130 0.490 418 H GLU 55 HN GLU 55 3.318 15.814 -0.612 419 HA GLU 55 HA GLU 55 5.309 14.704 -2.151 420 HB2 GLU 55 HB2 GLU 55 5.338 15.873 0.585 421 HB3 GLU 55 HB1 GLU 55 6.793 15.501 -0.246 422 HG2 GLU 55 HG2 GLU 55 6.009 16.990 -2.025 423 HG3 GLU 55 HG1 GLU 55 4.668 17.392 -1.011 424 H GLU 56 HN GLU 56 4.742 13.965 1.255 425 HA GLU 56 HA GLU 56 6.263 11.724 1.625 426 HB2 GLU 56 HB2 GLU 56 3.478 12.282 2.672 427 HB3 GLU 56 HB1 GLU 56 4.711 11.356 3.472 428 HG2 GLU 56 HG2 GLU 56 6.106 13.434 3.554 429 HG3 GLU 56 HG1 GLU 56 4.746 14.266 2.871 430 H LEU 57 HN LEU 57 2.839 11.811 0.998 431 HA LEU 57 HA LEU 57 2.180 9.225 0.484 432 HB2 LEU 57 HB2 LEU 57 1.144 11.703 -0.832 433 HB3 LEU 57 HB1 LEU 57 0.366 10.136 -0.967 434 HG LEU 57 HG LEU 57 0.937 11.339 1.709 435 HD11 LEU 57 HD11 LEU 57 -1.324 11.986 -0.148 436 HD12 LEU 57 HD12 LEU 57 -0.310 13.079 0.804 437 HD13 LEU 57 HD13 LEU 57 -1.510 12.063 1.602 438 HD21 LEU 57 HD21 LEU 57 -1.073 9.343 0.692 439 HD22 LEU 57 HD22 LEU 57 -0.956 9.904 2.356 440 HD23 LEU 57 HD23 LEU 57 0.364 8.991 1.636 441 H GLN 58 HN GLN 58 3.607 11.450 -1.860 442 HA GLN 58 HA GLN 58 3.216 9.780 -4.094 443 HB2 GLN 58 HB2 GLN 58 3.735 12.192 -4.293 444 HB3 GLN 58 HB1 GLN 58 5.361 11.862 -3.701 445 HG2 GLN 58 HG2 GLN 58 5.786 10.437 -5.625 446 HG3 GLN 58 HG1 GLN 58 4.158 10.741 -6.222 447 HE21 GLN 58 HE21 GLN 58 4.982 11.581 -8.131 448 HE22 GLN 58 HE22 GLN 58 5.687 13.158 -8.203 449 H GLU 59 HN GLU 59 5.927 10.173 -1.860 450 HA GLU 59 HA GLU 59 7.718 8.487 -3.156 451 HB2 GLU 59 HB2 GLU 59 7.456 8.937 -0.249 452 HB3 GLU 59 HB1 GLU 59 8.903 8.423 -1.075 453 HG2 GLU 59 HG2 GLU 59 7.508 11.052 -1.488 454 HG3 GLU 59 HG1 GLU 59 8.919 10.803 -0.475 455 H MET 60 HN MET 60 5.023 7.798 -1.082 456 HA MET 60 HA MET 60 5.637 5.063 -0.619 457 HB2 MET 60 HB2 MET 60 2.869 6.106 -0.679 458 HB3 MET 60 HB1 MET 60 3.521 4.849 0.325 459 HG2 MET 60 HG2 MET 60 4.959 6.978 1.171 460 HG3 MET 60 HG1 MET 60 3.441 7.741 0.742 461 HE1 MET 60 HE1 MET 60 1.090 7.086 1.807 462 HE2 MET 60 HE2 MET 60 0.889 5.732 2.930 463 HE3 MET 60 HE3 MET 60 1.384 5.435 1.261 464 H ILE 61 HN ILE 61 3.623 6.782 -2.916 465 HA ILE 61 HA ILE 61 2.730 4.548 -4.408 466 HB ILE 61 HB ILE 61 2.922 7.473 -5.017 467 HG12 ILE 61 HG12 ILE 61 0.800 5.558 -4.090 468 HG13 ILE 61 HG11 ILE 61 1.356 7.042 -3.321 469 HG21 ILE 61 HG21 ILE 61 1.523 7.118 -6.957 470 HG22 ILE 61 HG22 ILE 61 1.541 5.374 -6.694 471 HG23 ILE 61 HG23 ILE 61 3.026 6.212 -7.138 472 HD11 ILE 61 HD11 ILE 61 -0.818 7.356 -4.260 473 HD12 ILE 61 HD12 ILE 61 -0.240 6.804 -5.831 474 HD13 ILE 61 HD13 ILE 61 0.360 8.316 -5.155 475 H ASP 62 HN ASP 62 5.454 6.731 -4.712 476 HA ASP 62 HA ASP 62 6.304 6.269 -7.294 477 HB2 ASP 62 HB2 ASP 62 7.184 8.066 -5.899 478 HB3 ASP 62 HB1 ASP 62 7.915 6.897 -4.810 479 H GLU 63 HN GLU 63 6.953 4.368 -4.409 480 HA GLU 63 HA GLU 63 9.061 2.780 -5.152 481 HB2 GLU 63 HB2 GLU 63 8.091 2.669 -2.983 482 HB3 GLU 63 HB1 GLU 63 6.614 2.047 -3.665 483 HG2 GLU 63 HG2 GLU 63 7.931 0.313 -2.596 484 HG3 GLU 63 HG1 GLU 63 7.685 -0.004 -4.305 485 H VAL 64 HN VAL 64 5.652 2.102 -5.707 486 HA VAL 64 HA VAL 64 6.401 -0.055 -7.520 487 HB VAL 64 HB VAL 64 3.923 -0.572 -7.444 488 HG11 VAL 64 HG11 VAL 64 4.170 -1.610 -5.204 489 HG12 VAL 64 HG12 VAL 64 5.658 -0.694 -4.986 490 HG13 VAL 64 HG13 VAL 64 5.540 -1.891 -6.276 491 HG21 VAL 64 HG21 VAL 64 2.627 0.361 -5.665 492 HG22 VAL 64 HG22 VAL 64 3.332 1.709 -6.561 493 HG23 VAL 64 HG23 VAL 64 4.031 1.216 -5.021 494 H ASP 65 HN ASP 65 5.531 3.137 -7.642 495 HA ASP 65 HA ASP 65 3.885 3.227 -9.912 496 HB2 ASP 65 HB2 ASP 65 4.156 5.122 -8.380 497 HB3 ASP 65 HB1 ASP 65 5.820 5.252 -8.853 498 H GLU 66 HN GLU 66 4.913 1.594 -11.234 499 HA GLU 66 HA GLU 66 7.526 1.956 -12.264 500 HB2 GLU 66 HB2 GLU 66 5.250 0.138 -12.831 501 HB3 GLU 66 HB1 GLU 66 6.680 0.134 -13.813 502 HG2 GLU 66 HG2 GLU 66 6.535 -0.406 -10.908 503 HG3 GLU 66 HG1 GLU 66 6.847 -1.562 -12.177 504 H ASP 67 HN ASP 67 4.304 2.872 -13.267 505 HA ASP 67 HA ASP 67 5.135 3.420 -15.992 506 HB2 ASP 67 HB2 ASP 67 2.873 2.529 -15.482 507 HB3 ASP 67 HB1 ASP 67 2.503 4.010 -14.608 508 H GLY 68 HN GLY 68 5.398 4.980 -13.087 509 HA2 GLY 68 HA2 GLY 68 5.985 7.117 -12.490 510 HA3 GLY 68 HA1 GLY 68 6.325 7.407 -14.191 511 H SER 69 HN SER 69 3.263 6.431 -12.815 512 HA SER 69 HA SER 69 2.022 8.718 -14.143 513 HB2 SER 69 HB2 SER 69 1.198 6.397 -14.599 514 HB3 SER 69 HB1 SER 69 0.720 6.275 -12.907 515 HG SER 69 HG SER 69 -0.212 8.477 -14.334 516 H GLY 70 HN GLY 70 2.987 7.684 -11.074 517 HA2 GLY 70 HA2 GLY 70 2.794 8.768 -9.036 518 HA3 GLY 70 HA1 GLY 70 1.731 9.946 -9.798 519 H THR 71 HN THR 71 0.907 6.688 -10.338 520 HA THR 71 HA THR 71 -1.027 6.688 -8.139 521 HB THR 71 HB THR 71 -2.747 5.704 -9.657 522 HG1 THR 71 HG1 THR 71 -1.072 5.205 -11.314 523 HG21 THR 71 HG21 THR 71 -1.872 8.468 -10.503 524 HG22 THR 71 HG22 THR 71 -2.852 8.108 -9.078 525 HG23 THR 71 HG23 THR 71 -3.478 7.765 -10.698 526 H VAL 72 HN VAL 72 -1.203 4.857 -7.164 527 HA VAL 72 HA VAL 72 0.115 2.484 -8.174 528 HB VAL 72 HB VAL 72 -1.240 3.237 -5.607 529 HG11 VAL 72 HG11 VAL 72 -1.785 0.881 -6.214 530 HG12 VAL 72 HG12 VAL 72 -0.855 1.061 -4.735 531 HG13 VAL 72 HG13 VAL 72 -0.056 0.538 -6.196 532 HG21 VAL 72 HG21 VAL 72 0.882 4.089 -5.595 533 HG22 VAL 72 HG22 VAL 72 1.531 2.810 -6.603 534 HG23 VAL 72 HG23 VAL 72 1.193 2.507 -4.901 535 H ASP 73 HN ASP 73 -0.896 0.909 -9.238 536 HA ASP 73 HA ASP 73 -3.829 0.721 -8.972 537 HB2 ASP 73 HB2 ASP 73 -2.788 0.974 -11.289 538 HB3 ASP 73 HB1 ASP 73 -2.117 -0.618 -11.064 539 H PHE 74 HN PHE 74 -4.174 -2.001 -9.540 540 HA PHE 74 HA PHE 74 -4.188 -2.764 -6.894 541 HB2 PHE 74 HB2 PHE 74 -5.737 -3.769 -8.372 542 HB3 PHE 74 HB1 PHE 74 -4.457 -4.462 -9.357 543 HD1 PHE 74 HD1 PHE 74 -4.510 -4.462 -5.673 544 HD2 PHE 74 HD2 PHE 74 -5.113 -6.760 -9.206 545 HE1 PHE 74 HE1 PHE 74 -4.593 -6.511 -4.320 546 HE2 PHE 74 HE2 PHE 74 -5.199 -8.814 -7.850 547 HZ PHE 74 HZ PHE 74 -4.942 -8.686 -5.404 548 H ASP 75 HN ASP 75 -1.970 -4.235 -9.346 549 HA ASP 75 HA ASP 75 -0.736 -5.880 -7.444 550 HB2 ASP 75 HB2 ASP 75 0.974 -6.249 -9.100 551 HB3 ASP 75 HB1 ASP 75 -0.617 -6.328 -9.833 552 H GLU 76 HN GLU 76 0.014 -2.654 -8.567 553 HA GLU 76 HA GLU 76 2.433 -2.221 -7.303 554 HB2 GLU 76 HB2 GLU 76 0.185 -0.344 -7.717 555 HB3 GLU 76 HB1 GLU 76 1.799 0.130 -7.452 556 HG2 GLU 76 HG2 GLU 76 2.411 -0.979 -9.582 557 HG3 GLU 76 HG1 GLU 76 0.702 -1.299 -9.822 558 H PHE 77 HN PHE 77 -0.837 -1.567 -6.187 559 HA PHE 77 HA PHE 77 -0.366 -0.925 -3.507 560 HB2 PHE 77 HB2 PHE 77 -2.583 -0.720 -4.657 561 HB3 PHE 77 HB1 PHE 77 -2.739 -2.469 -4.577 562 HD1 PHE 77 HD1 PHE 77 -2.337 0.540 -2.448 563 HD2 PHE 77 HD2 PHE 77 -3.714 -3.488 -2.662 564 HE1 PHE 77 HE1 PHE 77 -3.295 0.754 -0.198 565 HE2 PHE 77 HE2 PHE 77 -4.674 -3.269 -0.399 566 HZ PHE 77 HZ PHE 77 -4.459 -1.150 0.834 567 H LEU 78 HN LEU 78 -1.061 -4.029 -4.945 568 HA LEU 78 HA LEU 78 -1.213 -5.590 -2.641 569 HB2 LEU 78 HB2 LEU 78 -2.046 -6.188 -4.856 570 HB3 LEU 78 HB1 LEU 78 -0.423 -6.277 -5.462 571 HG LEU 78 HG LEU 78 0.017 -8.291 -4.429 572 HD11 LEU 78 HD11 LEU 78 -0.567 -7.800 -2.206 573 HD12 LEU 78 HD12 LEU 78 -1.458 -9.243 -2.716 574 HD13 LEU 78 HD13 LEU 78 -2.280 -7.682 -2.630 575 HD21 LEU 78 HD21 LEU 78 -1.794 -8.441 -6.147 576 HD22 LEU 78 HD22 LEU 78 -2.937 -8.494 -4.791 577 HD23 LEU 78 HD23 LEU 78 -1.714 -9.757 -4.974 578 H VAL 79 HN VAL 79 1.634 -4.900 -4.687 579 HA VAL 79 HA VAL 79 3.239 -6.791 -3.305 580 HB VAL 79 HB VAL 79 3.700 -5.575 -5.614 581 HG11 VAL 79 HG11 VAL 79 3.907 -3.333 -4.663 582 HG12 VAL 79 HG12 VAL 79 5.457 -3.862 -5.305 583 HG13 VAL 79 HG13 VAL 79 5.168 -3.905 -3.571 584 HG21 VAL 79 HG21 VAL 79 5.811 -6.320 -3.634 585 HG22 VAL 79 HG22 VAL 79 6.040 -6.175 -5.376 586 HG23 VAL 79 HG23 VAL 79 4.958 -7.407 -4.725 587 H MET 80 HN MET 80 2.436 -3.395 -2.805 588 HA MET 80 HA MET 80 4.309 -3.006 -0.697 589 HB2 MET 80 HB2 MET 80 3.469 -0.996 -1.635 590 HB3 MET 80 HB1 MET 80 1.797 -1.532 -1.495 591 HG2 MET 80 HG2 MET 80 2.371 0.201 0.147 592 HG3 MET 80 HG1 MET 80 1.879 -1.307 0.909 593 HE1 MET 80 HE1 MET 80 4.442 -0.259 3.579 594 HE2 MET 80 HE2 MET 80 2.775 -0.693 3.196 595 HE3 MET 80 HE3 MET 80 3.406 0.882 2.728 596 H MET 81 HN MET 81 0.970 -4.121 -0.913 597 HA MET 81 HA MET 81 0.304 -4.331 1.696 598 HB2 MET 81 HB2 MET 81 -0.293 -5.940 -0.719 599 HB3 MET 81 HB1 MET 81 -0.988 -6.351 0.793 600 HG2 MET 81 HG2 MET 81 -1.469 -4.040 -0.914 601 HG3 MET 81 HG1 MET 81 -2.613 -5.018 -0.018 602 HE1 MET 81 HE1 MET 81 -1.270 -4.910 3.037 603 HE2 MET 81 HE2 MET 81 -2.911 -5.038 2.403 604 HE3 MET 81 HE3 MET 81 -2.493 -3.734 3.522 605 H VAL 82 HN VAL 82 1.880 -6.914 -0.223 606 HA VAL 82 HA VAL 82 2.322 -8.527 2.088 607 HB VAL 82 HB VAL 82 2.167 -9.539 -0.137 608 HG11 VAL 82 HG11 VAL 82 3.189 -7.962 -1.551 609 HG12 VAL 82 HG12 VAL 82 4.188 -9.413 -1.624 610 HG13 VAL 82 HG13 VAL 82 4.697 -8.034 -0.647 611 HG21 VAL 82 HG21 VAL 82 3.965 -11.123 0.054 612 HG22 VAL 82 HG22 VAL 82 3.366 -10.705 1.660 613 HG23 VAL 82 HG23 VAL 82 4.876 -10.008 1.068 614 H ARG 83 HN ARG 83 4.166 -6.068 0.431 615 HA ARG 83 HA ARG 83 6.617 -6.353 1.770 616 HB2 ARG 83 HB2 ARG 83 6.318 -4.917 -0.173 617 HB3 ARG 83 HB1 ARG 83 5.239 -3.892 0.744 618 HG2 ARG 83 HG2 ARG 83 7.163 -3.397 2.272 619 HG3 ARG 83 HG1 ARG 83 8.182 -4.227 1.099 620 HD2 ARG 83 HD2 ARG 83 7.828 -2.645 -0.544 621 HD3 ARG 83 HD1 ARG 83 6.339 -2.063 0.192 622 HE ARG 83 HE ARG 83 7.959 -1.228 2.017 623 HH11 ARG 83 HH11 ARG 83 8.843 -1.469 -1.356 624 HH12 ARG 83 HH12 ARG 83 9.722 0.038 -1.373 625 HH21 ARG 83 HH21 ARG 83 9.137 0.721 2.035 626 HH22 ARG 83 HH22 ARG 83 9.886 1.290 0.580 627 H SER 84 HN SER 84 3.679 -4.597 2.590 628 HA SER 84 HA SER 84 4.651 -3.255 4.857 629 HB2 SER 84 HB2 SER 84 2.584 -2.645 3.585 630 HB3 SER 84 HB1 SER 84 1.790 -4.056 4.278 631 HG SER 84 HG SER 84 1.570 -1.880 5.348 632 H MET 85 HN MET 85 2.948 -6.340 4.507 633 HA MET 85 HA MET 85 2.821 -6.726 7.344 634 HB2 MET 85 HB2 MET 85 1.856 -8.925 6.792 635 HB3 MET 85 HB1 MET 85 1.031 -7.593 6.002 636 HG2 MET 85 HG2 MET 85 2.540 -8.113 4.022 637 HG3 MET 85 HG1 MET 85 2.851 -9.644 4.827 638 HE1 MET 85 HE1 MET 85 -0.443 -7.475 4.689 639 HE2 MET 85 HE2 MET 85 -1.303 -8.251 3.362 640 HE3 MET 85 HE3 MET 85 0.193 -7.368 3.044 641 H LYS 86 HN LYS 86 5.029 -7.719 4.801 642 HA LYS 86 HA LYS 86 6.373 -9.594 6.524 643 HB2 LYS 86 HB2 LYS 86 6.641 -8.682 3.753 644 HB3 LYS 86 HB1 LYS 86 8.128 -9.201 4.521 645 HG2 LYS 86 HG2 LYS 86 7.311 -11.089 3.433 646 HG3 LYS 86 HG1 LYS 86 6.873 -11.321 5.123 647 HD2 LYS 86 HD2 LYS 86 4.622 -10.727 4.711 648 HD3 LYS 86 HD1 LYS 86 5.007 -10.137 3.095 649 HE2 LYS 86 HE2 LYS 86 3.970 -12.268 2.841 650 HE3 LYS 86 HE1 LYS 86 5.688 -12.471 2.495 651 HZ1 LYS 86 HZ1 LYS 86 4.884 -14.258 3.873 652 HZ2 LYS 86 HZ2 LYS 86 4.316 -13.169 5.033 653 HZ3 LYS 86 HZ3 LYS 86 5.975 -13.318 4.756 654 H ASP 87 HN ASP 87 7.212 -6.498 5.018 655 HA ASP 87 HA ASP 87 9.454 -5.682 5.010 656 HB2 ASP 87 HB2 ASP 87 7.619 -4.171 5.958 657 HB3 ASP 87 HB1 ASP 87 8.313 -4.526 7.539 658 H ASP 88 HN ASP 88 10.671 -7.618 5.444 659 HA ASP 88 HA ASP 88 11.249 -8.336 8.165 660 HB2 ASP 88 HB2 ASP 88 12.278 -9.393 5.539 661 HB3 ASP 88 HB1 ASP 88 12.788 -10.016 7.105 662 H SER 89 HN SER 89 12.584 -6.130 5.973 663 HA SER 89 HA SER 89 15.279 -6.257 6.952 664 HB2 SER 89 HB2 SER 89 13.891 -4.058 5.401 665 HB3 SER 89 HB1 SER 89 15.631 -4.223 5.634 666 HG SER 89 HG SER 89 13.888 -5.740 4.040 667 H LYS 90 HN LYS 90 14.653 -6.216 9.235 668 HA LYS 90 HA LYS 90 13.591 -3.735 10.287 669 HB2 LYS 90 HB2 LYS 90 14.575 -6.161 11.764 670 HB3 LYS 90 HB1 LYS 90 13.618 -4.853 12.436 671 HG2 LYS 90 HG2 LYS 90 11.749 -5.469 11.021 672 HG3 LYS 90 HG1 LYS 90 12.712 -6.751 10.284 673 HD2 LYS 90 HD2 LYS 90 11.275 -7.721 11.947 674 HD3 LYS 90 HD1 LYS 90 12.939 -7.793 12.522 675 HE2 LYS 90 HE2 LYS 90 12.566 -5.877 13.950 676 HE3 LYS 90 HE1 LYS 90 10.935 -5.681 13.311 677 HZ1 LYS 90 HZ1 LYS 90 11.921 -8.020 14.850 678 HZ2 LYS 90 HZ2 LYS 90 10.358 -7.839 14.233 679 HZ3 LYS 90 HZ3 LYS 90 10.912 -6.801 15.447 680 H GLY 136 HN GLY 136 16.537 -5.677 10.792 681 HA2 GLY 136 HA2 GLY 136 17.835 -3.203 11.751 682 HA3 GLY 136 HA1 GLY 136 18.148 -4.785 12.443 683 H LYS 137 HN LYS 137 17.834 -4.197 8.997 684 HA LYS 137 HA LYS 137 20.698 -4.056 8.677 685 HB2 LYS 137 HB2 LYS 137 20.681 -5.938 6.975 686 HB3 LYS 137 HB1 LYS 137 20.616 -6.395 8.667 687 HG2 LYS 137 HG2 LYS 137 19.113 -7.820 7.608 688 HG3 LYS 137 HG1 LYS 137 18.094 -6.586 8.343 689 HD2 LYS 137 HD2 LYS 137 17.652 -5.565 6.285 690 HD3 LYS 137 HD1 LYS 137 19.013 -6.364 5.495 691 HE2 LYS 137 HE2 LYS 137 16.560 -7.774 6.536 692 HE3 LYS 137 HE1 LYS 137 16.800 -7.295 4.857 693 HZ1 LYS 137 HZ1 LYS 137 18.755 -8.717 4.779 694 HZ2 LYS 137 HZ2 LYS 137 17.381 -9.605 5.203 695 HZ3 LYS 137 HZ3 LYS 137 18.509 -9.182 6.387 696 H PHE 138 HN PHE 138 20.859 -4.545 5.964 697 HA PHE 138 HA PHE 138 20.455 -2.003 5.019 698 HB2 PHE 138 HB2 PHE 138 22.051 -3.485 4.008 699 HB3 PHE 138 HB1 PHE 138 20.775 -4.574 3.477 700 HD1 PHE 138 HD1 PHE 138 20.028 -4.416 1.317 701 HD2 PHE 138 HD2 PHE 138 21.830 -1.019 3.128 702 HE1 PHE 138 HE1 PHE 138 19.873 -3.200 -0.818 703 HE2 PHE 138 HE2 PHE 138 21.681 0.206 0.999 704 HZ PHE 138 HZ PHE 138 20.700 -0.887 -0.978 705 H LYS 139 HN LYS 139 18.807 -0.894 4.472 706 HA LYS 139 HA LYS 139 17.024 -1.842 2.438 707 HB2 LYS 139 HB2 LYS 139 14.942 -1.230 3.544 708 HB3 LYS 139 HB1 LYS 139 15.755 -2.466 4.490 709 HG2 LYS 139 HG2 LYS 139 16.132 -1.080 6.242 710 HG3 LYS 139 HG1 LYS 139 16.312 0.343 5.216 711 HD2 LYS 139 HD2 LYS 139 14.304 0.473 6.623 712 HD3 LYS 139 HD1 LYS 139 13.903 0.459 4.908 713 HE2 LYS 139 HE2 LYS 139 13.263 -1.858 5.030 714 HE3 LYS 139 HE1 LYS 139 13.824 -1.966 6.697 715 HZ1 LYS 139 HZ1 LYS 139 12.114 -0.407 7.351 716 HZ2 LYS 139 HZ2 LYS 139 11.412 -1.733 6.566 717 HZ3 LYS 139 HZ3 LYS 139 11.585 -0.258 5.752 718 H ARG 140 HN ARG 140 16.097 -0.043 1.288 719 HA ARG 140 HA ARG 140 17.305 2.518 2.025 720 HB2 ARG 140 HB2 ARG 140 16.149 3.231 -0.216 721 HB3 ARG 140 HB1 ARG 140 17.669 2.368 -0.223 722 HG2 ARG 140 HG2 ARG 140 16.312 1.422 -1.918 723 HG3 ARG 140 HG1 ARG 140 16.373 0.254 -0.604 724 HD2 ARG 140 HD2 ARG 140 14.175 1.056 0.172 725 HD3 ARG 140 HD1 ARG 140 14.118 2.168 -1.197 726 HE ARG 140 HE ARG 140 14.373 -0.010 -2.556 727 HH11 ARG 140 HH11 ARG 140 12.563 0.300 0.428 728 HH12 ARG 140 HH12 ARG 140 11.455 -0.972 0.028 729 HH21 ARG 140 HH21 ARG 140 12.913 -1.670 -3.069 730 HH22 ARG 140 HH22 ARG 140 11.668 -2.117 -1.937 731 HA PRO 141 HA PRO 141 13.667 3.985 3.864 732 HB2 PRO 141 HB2 PRO 141 14.646 6.683 3.566 733 HB3 PRO 141 HB1 PRO 141 14.644 5.668 5.005 734 HG2 PRO 141 HG2 PRO 141 16.908 6.414 3.665 735 HG3 PRO 141 HG1 PRO 141 16.778 4.993 4.695 736 HD2 PRO 141 HD2 PRO 141 16.691 5.225 1.730 737 HD3 PRO 141 HD1 PRO 141 17.412 3.998 2.771 738 H THR 142 HN THR 142 11.736 4.366 3.016 739 HA THR 142 HA THR 142 11.580 5.965 0.561 740 HB THR 142 HB THR 142 9.187 4.779 0.571 741 HG1 THR 142 HG1 THR 142 9.497 3.558 2.434 742 HG21 THR 142 HG21 THR 142 10.795 4.668 -1.264 743 HG22 THR 142 HG22 THR 142 10.117 3.071 -0.944 744 HG23 THR 142 HG23 THR 142 11.741 3.471 -0.383 745 H LEU 143 HN LEU 143 11.781 7.231 2.991 746 HA LEU 143 HA LEU 143 10.866 8.974 4.125 747 HB2 LEU 143 HB2 LEU 143 8.792 8.485 2.118 748 HB3 LEU 143 HB1 LEU 143 8.186 9.166 3.611 749 HG LEU 143 HG LEU 143 9.894 11.009 3.341 750 HD11 LEU 143 HD11 LEU 143 10.732 11.349 1.085 751 HD12 LEU 143 HD12 LEU 143 10.104 9.762 0.631 752 HD13 LEU 143 HD13 LEU 143 11.396 9.894 1.832 753 HD21 LEU 143 HD21 LEU 143 7.589 11.372 2.781 754 HD22 LEU 143 HD22 LEU 143 7.830 10.630 1.198 755 HD23 LEU 143 HD23 LEU 143 8.624 12.158 1.590 756 H ARG 144 HN ARG 144 11.126 7.793 6.066 757 HA ARG 144 HA ARG 144 8.764 6.513 7.115 758 HB2 ARG 144 HB2 ARG 144 9.985 6.632 9.318 759 HB3 ARG 144 HB1 ARG 144 10.777 5.700 8.061 760 HG2 ARG 144 HG2 ARG 144 12.460 7.280 7.777 761 HG3 ARG 144 HG1 ARG 144 11.519 8.558 8.556 762 HD2 ARG 144 HD2 ARG 144 13.418 7.551 9.916 763 HD3 ARG 144 HD1 ARG 144 11.842 7.634 10.697 764 HE ARG 144 HE ARG 144 12.950 5.173 9.496 765 HH11 ARG 144 HH11 ARG 144 11.147 6.820 12.019 766 HH12 ARG 144 HH12 ARG 144 10.761 5.358 12.867 767 HH21 ARG 144 HH21 ARG 144 12.435 3.248 10.642 768 HH22 ARG 144 HH22 ARG 144 11.485 3.341 12.090 769 H ARG 145 HN ARG 145 7.379 8.178 6.529 770 HA ARG 145 HA ARG 145 7.491 10.641 8.150 771 HB2 ARG 145 HB2 ARG 145 6.379 10.010 5.431 772 HB3 ARG 145 HB1 ARG 145 5.959 11.478 6.308 773 HG2 ARG 145 HG2 ARG 145 8.804 10.751 5.885 774 HG3 ARG 145 HG1 ARG 145 7.880 11.527 4.597 775 HD2 ARG 145 HD2 ARG 145 8.793 13.318 5.688 776 HD3 ARG 145 HD1 ARG 145 7.197 13.180 6.435 777 HE ARG 145 HE ARG 145 9.311 11.786 7.822 778 HH11 ARG 145 HH11 ARG 145 7.479 14.747 7.524 779 HH12 ARG 145 HH12 ARG 145 7.893 15.315 9.109 780 HH21 ARG 145 HH21 ARG 145 9.852 12.513 9.914 781 HH22 ARG 145 HH22 ARG 145 9.241 14.041 10.476 782 H VAL 146 HN VAL 146 5.343 8.471 6.484 783 HA VAL 146 HA VAL 146 3.489 8.353 8.724 784 HB VAL 146 HB VAL 146 1.651 8.586 6.879 785 HG11 VAL 146 HG11 VAL 146 2.005 10.216 8.712 786 HG12 VAL 146 HG12 VAL 146 1.444 10.948 7.204 787 HG13 VAL 146 HG13 VAL 146 3.147 11.076 7.669 788 HG21 VAL 146 HG21 VAL 146 2.246 10.065 5.032 789 HG22 VAL 146 HG22 VAL 146 3.207 8.586 4.981 790 HG23 VAL 146 HG23 VAL 146 3.923 10.083 5.578 791 H ARG 147 HN ARG 147 4.017 6.149 9.009 792 HA ARG 147 HA ARG 147 4.187 4.489 6.611 793 HB2 ARG 147 HB2 ARG 147 5.779 4.535 8.785 794 HB3 ARG 147 HB1 ARG 147 4.648 3.290 9.283 795 HG2 ARG 147 HG2 ARG 147 6.389 3.280 6.825 796 HG3 ARG 147 HG1 ARG 147 6.566 2.268 8.255 797 HD2 ARG 147 HD2 ARG 147 4.177 1.434 7.661 798 HD3 ARG 147 HD1 ARG 147 4.505 2.140 6.083 799 HE ARG 147 HE ARG 147 6.605 0.653 6.194 800 HH11 ARG 147 HH11 ARG 147 3.460 -0.191 7.477 801 HH12 ARG 147 HH12 ARG 147 3.721 -1.902 7.346 802 HH21 ARG 147 HH21 ARG 147 6.955 -1.599 6.014 803 HH22 ARG 147 HH22 ARG 147 5.719 -2.699 6.531 804 H ILE 148 HN ILE 148 2.322 3.733 5.929 805 HA ILE 148 HA ILE 148 0.111 3.191 7.637 806 HB ILE 148 HB ILE 148 0.620 3.272 4.806 807 HG12 ILE 148 HG12 ILE 148 -1.907 3.415 6.479 808 HG13 ILE 148 HG11 ILE 148 -0.926 4.747 5.954 809 HG21 ILE 148 HG21 ILE 148 0.461 0.892 4.779 810 HG22 ILE 148 HG22 ILE 148 -1.023 1.563 4.091 811 HG23 ILE 148 HG23 ILE 148 -1.018 0.931 5.740 812 HD11 ILE 148 HD11 ILE 148 -3.159 4.021 4.762 813 HD12 ILE 148 HD12 ILE 148 -2.018 3.037 3.842 814 HD13 ILE 148 HD13 ILE 148 -1.820 4.790 3.920 815 H SER 149 HN SER 149 -0.308 1.400 8.782 816 HA SER 149 HA SER 149 1.374 -0.933 8.531 817 HB2 SER 149 HB2 SER 149 -1.042 -0.468 10.285 818 HB3 SER 149 HB1 SER 149 0.115 -1.778 10.456 819 HG SER 149 HG SER 149 1.591 0.337 10.455 820 H ALA 150 HN ALA 150 0.703 -2.977 7.852 821 HA ALA 150 HA ALA 150 -0.816 -3.020 5.547 822 HB1 ALA 150 HB1 ALA 150 -0.697 -5.437 5.666 823 HB2 ALA 150 HB2 ALA 150 -0.279 -5.353 7.377 824 HB3 ALA 150 HB3 ALA 150 0.839 -4.728 6.165 825 H ASP 151 HN ASP 151 -1.773 -4.474 8.641 826 HA ASP 151 HA ASP 151 -4.441 -5.007 7.748 827 HB2 ASP 151 HB2 ASP 151 -3.429 -4.971 10.594 828 HB3 ASP 151 HB1 ASP 151 -4.827 -5.834 9.967 829 H ALA 152 HN ALA 152 -2.971 -2.599 9.887 830 HA ALA 152 HA ALA 152 -5.322 -1.473 10.867 831 HB1 ALA 152 HB1 ALA 152 -2.880 -1.042 11.562 832 HB2 ALA 152 HB2 ALA 152 -4.055 0.273 11.668 833 HB3 ALA 152 HB3 ALA 152 -2.916 0.208 10.317 834 H MET 153 HN MET 153 -3.403 -0.592 8.005 835 HA MET 153 HA MET 153 -5.153 1.432 7.096 836 HB2 MET 153 HB2 MET 153 -3.056 1.443 6.055 837 HB3 MET 153 HB1 MET 153 -3.116 -0.284 5.716 838 HG2 MET 153 HG2 MET 153 -5.286 1.254 4.477 839 HG3 MET 153 HG1 MET 153 -3.664 1.688 3.921 840 HE1 MET 153 HE1 MET 153 -1.887 -0.747 3.616 841 HE2 MET 153 HE2 MET 153 -2.293 0.409 2.348 842 HE3 MET 153 HE3 MET 153 -2.391 -1.326 2.022 843 H MET 154 HN MET 154 -4.745 -1.945 6.203 844 HA MET 154 HA MET 154 -6.693 -2.245 4.322 845 HB2 MET 154 HB2 MET 154 -5.313 -3.977 6.243 846 HB3 MET 154 HB1 MET 154 -6.832 -4.628 5.674 847 HG2 MET 154 HG2 MET 154 -6.075 -4.445 3.380 848 HG3 MET 154 HG1 MET 154 -4.581 -3.680 3.919 849 HE1 MET 154 HE1 MET 154 -6.571 -6.674 5.463 850 HE2 MET 154 HE2 MET 154 -5.728 -8.052 4.750 851 HE3 MET 154 HE3 MET 154 -6.658 -6.961 3.723 852 H GLN 155 HN GLN 155 -7.049 -2.508 7.821 853 HA GLN 155 HA GLN 155 -9.695 -3.376 7.870 854 HB2 GLN 155 HB2 GLN 155 -7.901 -2.016 9.829 855 HB3 GLN 155 HB1 GLN 155 -9.610 -2.245 10.217 856 HG2 GLN 155 HG2 GLN 155 -9.434 -4.595 9.960 857 HG3 GLN 155 HG1 GLN 155 -7.814 -4.451 9.303 858 HE21 GLN 155 HE21 GLN 155 -7.049 -2.410 11.262 859 HE22 GLN 155 HE22 GLN 155 -6.817 -3.239 12.757 860 H ALA 156 HN ALA 156 -8.311 -0.208 7.575 861 HA ALA 156 HA ALA 156 -10.569 1.354 8.178 862 HB1 ALA 156 HB1 ALA 156 -9.477 3.148 7.012 863 HB2 ALA 156 HB2 ALA 156 -8.397 2.010 6.203 864 HB3 ALA 156 HB3 ALA 156 -8.295 2.239 7.947 865 H LEU 157 HN LEU 157 -9.416 -0.094 5.166 866 HA LEU 157 HA LEU 157 -11.760 0.776 3.731 867 HB2 LEU 157 HB2 LEU 157 -9.806 -1.273 2.850 868 HB3 LEU 157 HB1 LEU 157 -10.971 -0.478 1.885 869 HG LEU 157 HG LEU 157 -9.197 0.659 1.164 870 HD11 LEU 157 HD11 LEU 157 -8.851 2.717 2.087 871 HD12 LEU 157 HD12 LEU 157 -9.286 2.190 3.710 872 HD13 LEU 157 HD13 LEU 157 -10.532 2.328 2.453 873 HD21 LEU 157 HD21 LEU 157 -7.132 0.931 2.176 874 HD22 LEU 157 HD22 LEU 157 -7.662 -0.720 2.534 875 HD23 LEU 157 HD23 LEU 157 -7.769 0.528 3.776 876 H LEU 158 HN LEU 158 -10.580 -2.023 5.376 877 HA LEU 158 HA LEU 158 -12.225 -3.902 3.998 878 HB2 LEU 158 HB2 LEU 158 -9.962 -3.980 5.753 879 HB3 LEU 158 HB1 LEU 158 -11.132 -5.163 6.219 880 HG LEU 158 HG LEU 158 -11.082 -5.751 3.700 881 HD11 LEU 158 HD11 LEU 158 -8.483 -4.363 4.167 882 HD12 LEU 158 HD12 LEU 158 -9.773 -3.866 3.066 883 HD13 LEU 158 HD13 LEU 158 -8.870 -5.350 2.746 884 HD21 LEU 158 HD21 LEU 158 -8.884 -6.424 5.621 885 HD22 LEU 158 HD22 LEU 158 -9.219 -7.299 4.127 886 HD23 LEU 158 HD23 LEU 158 -10.410 -7.281 5.424 887 H GLY 159 HN GLY 159 -13.523 -1.843 5.946 888 HA2 GLY 159 HA2 GLY 159 -14.856 -3.467 7.859 889 HA3 GLY 159 HA1 GLY 159 -15.470 -1.962 7.199 890 H ALA 160 HN ALA 160 -15.065 -5.370 6.518 891 HA ALA 160 HA ALA 160 -17.473 -5.821 5.128 892 HB1 ALA 160 HB1 ALA 160 -16.525 -6.056 2.845 893 HB2 ALA 160 HB2 ALA 160 -15.013 -5.344 3.420 894 HB3 ALA 160 HB3 ALA 160 -16.496 -4.386 3.414 895 H ARG 161 HN ARG 161 -14.026 -6.556 5.352 896 HA ARG 161 HA ARG 161 -14.589 -9.260 6.185 897 HB2 ARG 161 HB2 ARG 161 -13.199 -10.334 4.460 898 HB3 ARG 161 HB1 ARG 161 -14.607 -9.552 3.765 899 HG2 ARG 161 HG2 ARG 161 -13.302 -7.791 2.884 900 HG3 ARG 161 HG1 ARG 161 -11.890 -8.276 3.829 901 HD2 ARG 161 HD2 ARG 161 -13.187 -10.019 1.759 902 HD3 ARG 161 HD1 ARG 161 -11.836 -8.944 1.406 903 HE ARG 161 HE ARG 161 -10.816 -10.359 3.405 904 HH11 ARG 161 HH11 ARG 161 -12.697 -11.463 0.659 905 HH12 ARG 161 HH12 ARG 161 -11.906 -13.006 0.582 906 HH21 ARG 161 HH21 ARG 161 -9.774 -12.360 3.302 907 HH22 ARG 161 HH22 ARG 161 -10.243 -13.522 2.090 908 H ALA 162 HN ALA 162 -13.387 -6.941 7.374 909 HA ALA 162 HA ALA 162 -10.532 -7.329 7.424 910 HB1 ALA 162 HB1 ALA 162 -11.033 -5.788 9.614 911 HB2 ALA 162 HB2 ALA 162 -12.421 -5.397 8.584 912 HB3 ALA 162 HB3 ALA 162 -10.778 -5.164 7.987 913 H LYS 163 HN LYS 163 -9.306 -8.039 9.199 914 HA LYS 163 HA LYS 163 -10.313 -10.100 10.803 915 HB2 LYS 163 HB2 LYS 163 -8.260 -9.394 12.301 916 HB3 LYS 163 HB1 LYS 163 -8.016 -10.162 10.740 917 HG2 LYS 163 HG2 LYS 163 -7.304 -8.207 9.739 918 HG3 LYS 163 HG1 LYS 163 -8.087 -7.182 10.940 919 HD2 LYS 163 HD2 LYS 163 -5.774 -8.989 11.593 920 HD3 LYS 163 HD1 LYS 163 -5.564 -7.321 11.057 921 HE2 LYS 163 HE2 LYS 163 -6.911 -6.540 12.929 922 HE3 LYS 163 HE1 LYS 163 -7.148 -8.201 13.464 923 HZ1 LYS 163 HZ1 LYS 163 -4.558 -6.761 13.338 924 HZ2 LYS 163 HZ2 LYS 163 -4.738 -8.380 13.781 925 HZ3 LYS 163 HZ3 LYS 163 -5.412 -7.161 14.739 926 H GLY 164 HN GLY 164 -9.849 -6.652 11.451 927 HA2 GLY 164 HA2 GLY 164 -11.613 -6.906 13.802 928 HA3 GLY 164 HA1 GLY 164 -10.462 -5.600 13.543 929 H HIS 165 HN HIS 165 -11.526 -3.770 13.212 930 HA HIS 165 HA HIS 165 -13.339 -3.579 10.970 931 HB2 HIS 165 HB2 HIS 165 -14.859 -4.226 12.818 932 HB3 HIS 165 HB1 HIS 165 -14.307 -2.834 13.742 933 HD1 HIS 165 HD1 HIS 165 -15.917 -0.970 13.642 934 HD2 HIS 165 HD2 HIS 165 -15.962 -3.208 10.145 935 HE1 HIS 165 HE1 HIS 165 -17.661 0.097 12.182 936 HE2 HIS 165 HE2 HIS 165 -17.781 -1.370 10.138 937 HAB 9XG 201 HAB DRG 201 6.580 4.530 2.761 938 HAC 9XG 201 HAC DRG 201 7.907 4.049 1.678 939 HAA 9XG 201 HAA DRG 201 7.375 2.952 2.978 940 HAD 9XG 201 HAD DRG 201 -1.624 2.551 -1.957 941 HAE 9XG 201 HAE DRG 201 -1.739 1.569 0.319 942 HAF 9XG 201 HAF DRG 201 0.478 3.598 -2.746 943 HAG 9XG 201 HAG DRG 201 5.971 1.428 -1.568 944 HAH 9XG 201 HAH DRG 201 7.625 2.464 -0.033 945 HAI 9XG 201 HAI DRG 201 0.261 1.594 1.781 946 HAJ 9XG 201 HAJ DRG 201 2.481 3.617 -1.289 947 HAK 9XG 201 HAK DRG 201 3.557 1.510 -1.030 948 HAL 9XG 201 HAL DRG 201 4.438 3.636 2.600 949 HAM 9XG 201 HAM DRG 201 2.354 2.669 2.112 Start of MODEL 2 1 H1 MET 1 HT1 MET 1 11.904 -2.691 -8.950 2 H2 MET 1 HT2 MET 1 11.995 -1.564 -7.694 3 H3 MET 1 HT3 MET 1 10.988 -1.275 -9.023 4 HA MET 1 HA MET 1 9.691 -1.987 -7.111 5 HB2 MET 1 HB2 MET 1 9.078 -2.607 -9.502 6 HB3 MET 1 HB1 MET 1 9.814 -4.176 -9.202 7 HG2 MET 1 HG2 MET 1 7.420 -4.278 -8.925 8 HG3 MET 1 HG1 MET 1 8.220 -4.575 -7.383 9 HE1 MET 1 HE1 MET 1 4.816 -2.715 -6.553 10 HE2 MET 1 HE2 MET 1 5.864 -3.998 -5.952 11 HE3 MET 1 HE3 MET 1 5.248 -4.075 -7.599 12 H ASP 2 HN ASP 2 9.520 -3.357 -5.321 13 HA ASP 2 HA ASP 2 11.636 -5.155 -4.696 14 HB2 ASP 2 HB2 ASP 2 8.849 -5.063 -3.512 15 HB3 ASP 2 HB1 ASP 2 10.221 -5.953 -2.861 16 H ASP 3 HN ASP 3 11.831 -6.533 -6.454 17 HA ASP 3 HA ASP 3 9.682 -8.078 -7.446 18 HB2 ASP 3 HB2 ASP 3 11.393 -9.450 -8.539 19 HB3 ASP 3 HB1 ASP 3 11.633 -7.733 -8.796 20 H ILE 4 HN ILE 4 11.480 -8.267 -4.596 21 HA ILE 4 HA ILE 4 11.201 -11.044 -4.154 22 HB ILE 4 HB ILE 4 12.800 -9.720 -2.860 23 HG12 ILE 4 HG12 ILE 4 11.593 -11.844 -1.941 24 HG13 ILE 4 HG11 ILE 4 12.595 -10.886 -0.861 25 HG21 ILE 4 HG21 ILE 4 11.567 -7.671 -2.666 26 HG22 ILE 4 HG22 ILE 4 12.042 -8.242 -1.066 27 HG23 ILE 4 HG23 ILE 4 10.382 -8.457 -1.626 28 HD11 ILE 4 HD11 ILE 4 9.601 -10.663 -1.069 29 HD12 ILE 4 HD12 ILE 4 10.644 -9.852 0.098 30 HD13 ILE 4 HD13 ILE 4 10.461 -11.609 0.150 31 H TYR 5 HN TYR 5 9.312 -8.207 -3.230 32 HA TYR 5 HA TYR 5 7.184 -9.724 -2.116 33 HB2 TYR 5 HB2 TYR 5 7.527 -6.814 -2.759 34 HB3 TYR 5 HB1 TYR 5 6.138 -7.482 -1.944 35 HD1 TYR 5 HD1 TYR 5 7.054 -9.255 -0.068 36 HD2 TYR 5 HD2 TYR 5 8.853 -5.645 -1.298 37 HE1 TYR 5 HE1 TYR 5 8.158 -9.096 2.111 38 HE2 TYR 5 HE2 TYR 5 9.974 -5.433 0.868 39 HH TYR 5 HH TYR 5 9.564 -6.303 3.249 40 H LYS 6 HN LYS 6 8.094 -8.298 -5.113 41 HA LYS 6 HA LYS 6 5.637 -8.309 -6.457 42 HB2 LYS 6 HB2 LYS 6 8.000 -7.380 -7.066 43 HB3 LYS 6 HB1 LYS 6 8.192 -8.936 -7.865 44 HG2 LYS 6 HG2 LYS 6 6.203 -8.465 -9.197 45 HG3 LYS 6 HG1 LYS 6 6.053 -6.898 -8.413 46 HD2 LYS 6 HD2 LYS 6 8.318 -6.324 -9.230 47 HD3 LYS 6 HD1 LYS 6 8.359 -7.854 -10.107 48 HE2 LYS 6 HE2 LYS 6 6.376 -5.618 -10.521 49 HE3 LYS 6 HE1 LYS 6 7.733 -6.004 -11.575 50 HZ1 LYS 6 HZ1 LYS 6 6.706 -8.174 -11.994 51 HZ2 LYS 6 HZ2 LYS 6 5.701 -6.899 -12.465 52 HZ3 LYS 6 HZ3 LYS 6 5.385 -7.738 -11.032 53 H ALA 7 HN ALA 7 8.128 -10.718 -5.965 54 HA ALA 7 HA ALA 7 6.806 -12.924 -7.248 55 HB1 ALA 7 HB1 ALA 7 8.436 -14.239 -5.838 56 HB2 ALA 7 HB2 ALA 7 9.053 -12.681 -5.263 57 HB3 ALA 7 HB3 ALA 7 9.133 -13.090 -6.982 58 H ALA 8 HN ALA 8 6.589 -11.394 -4.158 59 HA ALA 8 HA ALA 8 5.605 -13.677 -2.771 60 HB1 ALA 8 HB1 ALA 8 5.190 -12.204 -0.961 61 HB2 ALA 8 HB2 ALA 8 5.379 -10.798 -2.013 62 HB3 ALA 8 HB3 ALA 8 6.766 -11.838 -1.667 63 H VAL 9 HN VAL 9 4.122 -11.049 -4.585 64 HA VAL 9 HA VAL 9 1.455 -11.781 -3.845 65 HB VAL 9 HB VAL 9 0.986 -9.893 -4.960 66 HG11 VAL 9 HG11 VAL 9 3.686 -10.031 -6.260 67 HG12 VAL 9 HG12 VAL 9 3.344 -9.288 -4.696 68 HG13 VAL 9 HG13 VAL 9 2.637 -8.613 -6.167 69 HG21 VAL 9 HG21 VAL 9 0.317 -11.373 -6.781 70 HG22 VAL 9 HG22 VAL 9 1.935 -11.261 -7.465 71 HG23 VAL 9 HG23 VAL 9 0.909 -9.828 -7.387 72 H GLU 10 HN GLU 10 3.808 -12.819 -6.161 73 HA GLU 10 HA GLU 10 2.135 -14.588 -7.593 74 HB2 GLU 10 HB2 GLU 10 5.045 -15.110 -7.407 75 HB3 GLU 10 HB1 GLU 10 3.994 -15.114 -8.827 76 HG2 GLU 10 HG2 GLU 10 3.863 -12.613 -8.481 77 HG3 GLU 10 HG1 GLU 10 5.132 -12.832 -7.352 78 H GLN 11 HN GLN 11 3.151 -14.437 -4.587 79 HA GLN 11 HA GLN 11 3.489 -17.293 -4.021 80 HB2 GLN 11 HB2 GLN 11 5.401 -15.784 -3.671 81 HB3 GLN 11 HB1 GLN 11 4.454 -14.931 -2.501 82 HG2 GLN 11 HG2 GLN 11 6.117 -16.638 -1.763 83 HG3 GLN 11 HG1 GLN 11 4.538 -16.609 -1.045 84 HE21 GLN 11 HE21 GLN 11 6.677 -18.270 -3.224 85 HE22 GLN 11 HE22 GLN 11 5.831 -19.781 -3.243 86 H LEU 12 HN LEU 12 1.550 -14.484 -3.537 87 HA LEU 12 HA LEU 12 0.285 -15.373 -1.131 88 HB2 LEU 12 HB2 LEU 12 -0.638 -13.272 -3.072 89 HB3 LEU 12 HB1 LEU 12 -1.289 -13.584 -1.535 90 HG LEU 12 HG LEU 12 1.555 -12.760 -1.772 91 HD11 LEU 12 HD11 LEU 12 0.862 -10.477 -1.499 92 HD12 LEU 12 HD12 LEU 12 -0.825 -10.954 -1.375 93 HD13 LEU 12 HD13 LEU 12 0.019 -11.118 -2.905 94 HD21 LEU 12 HD21 LEU 12 -0.550 -12.621 0.381 95 HD22 LEU 12 HD22 LEU 12 1.114 -12.056 0.541 96 HD23 LEU 12 HD23 LEU 12 0.779 -13.771 0.313 97 H THR 13 HN THR 13 -1.802 -16.192 -0.953 98 HA THR 13 HA THR 13 -2.607 -17.907 -3.089 99 HB THR 13 HB THR 13 -4.501 -18.474 -1.626 100 HG1 THR 13 HG1 THR 13 -4.414 -17.497 0.545 101 HG21 THR 13 HG21 THR 13 -2.372 -19.636 -1.318 102 HG22 THR 13 HG22 THR 13 -3.221 -19.446 0.219 103 HG23 THR 13 HG23 THR 13 -1.867 -18.390 -0.177 104 H GLU 14 HN GLU 14 -5.054 -17.907 -3.622 105 HA GLU 14 HA GLU 14 -5.713 -15.648 -5.079 106 HB2 GLU 14 HB2 GLU 14 -6.912 -17.443 -5.782 107 HB3 GLU 14 HB1 GLU 14 -7.130 -18.077 -4.159 108 HG2 GLU 14 HG2 GLU 14 -8.913 -16.649 -3.739 109 HG3 GLU 14 HG1 GLU 14 -8.511 -15.637 -5.106 110 H GLU 15 HN GLU 15 -7.080 -16.670 -1.966 111 HA GLU 15 HA GLU 15 -8.625 -14.373 -1.546 112 HB2 GLU 15 HB2 GLU 15 -7.444 -16.286 0.470 113 HB3 GLU 15 HB1 GLU 15 -8.644 -15.059 0.851 114 HG2 GLU 15 HG2 GLU 15 -10.176 -16.124 -0.769 115 HG3 GLU 15 HG1 GLU 15 -8.989 -17.410 -0.991 116 H GLN 16 HN GLN 16 -5.234 -15.008 -0.874 117 HA GLN 16 HA GLN 16 -4.675 -12.961 0.893 118 HB2 GLN 16 HB2 GLN 16 -3.066 -14.332 -1.171 119 HB3 GLN 16 HB1 GLN 16 -2.409 -13.003 -0.269 120 HG2 GLN 16 HG2 GLN 16 -3.646 -15.328 1.057 121 HG3 GLN 16 HG1 GLN 16 -1.972 -15.360 0.587 122 HE21 GLN 16 HE21 GLN 16 -1.030 -15.335 2.571 123 HE22 GLN 16 HE22 GLN 16 -1.225 -14.090 3.748 124 H LYS 17 HN LYS 17 -4.488 -12.929 -2.592 125 HA LYS 17 HA LYS 17 -3.800 -10.155 -2.655 126 HB2 LYS 17 HB2 LYS 17 -4.653 -11.973 -4.911 127 HB3 LYS 17 HB1 LYS 17 -3.692 -10.507 -5.034 128 HG2 LYS 17 HG2 LYS 17 -1.836 -11.499 -4.026 129 HG3 LYS 17 HG1 LYS 17 -2.778 -12.864 -3.442 130 HD2 LYS 17 HD2 LYS 17 -1.385 -13.423 -5.400 131 HD3 LYS 17 HD1 LYS 17 -3.122 -13.632 -5.702 132 HE2 LYS 17 HE2 LYS 17 -3.194 -11.405 -6.712 133 HE3 LYS 17 HE1 LYS 17 -1.472 -11.253 -6.477 134 HZ1 LYS 17 HZ1 LYS 17 -2.004 -11.962 -8.743 135 HZ2 LYS 17 HZ2 LYS 17 -2.762 -13.349 -8.143 136 HZ3 LYS 17 HZ3 LYS 17 -1.099 -13.139 -7.935 137 H ASN 18 HN ASN 18 -6.700 -12.049 -2.812 138 HA ASN 18 HA ASN 18 -8.390 -10.071 -3.956 139 HB2 ASN 18 HB2 ASN 18 -8.938 -12.505 -3.878 140 HB3 ASN 18 HB1 ASN 18 -9.136 -12.370 -2.136 141 HD21 ASN 18 HD21 ASN 18 -10.466 -11.447 -5.245 142 HD22 ASN 18 HD22 ASN 18 -12.036 -11.030 -4.648 143 H GLU 19 HN GLU 19 -7.485 -10.915 -0.659 144 HA GLU 19 HA GLU 19 -9.261 -9.193 0.708 145 HB2 GLU 19 HB2 GLU 19 -7.796 -11.112 1.609 146 HB3 GLU 19 HB1 GLU 19 -6.528 -9.921 1.659 147 HG2 GLU 19 HG2 GLU 19 -7.656 -8.598 3.237 148 HG3 GLU 19 HG1 GLU 19 -9.142 -9.515 3.036 149 H PHE 20 HN PHE 20 -5.956 -8.880 -0.334 150 HA PHE 20 HA PHE 20 -5.581 -6.241 0.619 151 HB2 PHE 20 HB2 PHE 20 -4.081 -7.618 -1.609 152 HB3 PHE 20 HB1 PHE 20 -3.537 -6.254 -0.646 153 HD1 PHE 20 HD1 PHE 20 -1.866 -8.543 -0.978 154 HD2 PHE 20 HD2 PHE 20 -4.909 -7.885 1.896 155 HE1 PHE 20 HE1 PHE 20 -0.791 -10.170 0.484 156 HE2 PHE 20 HE2 PHE 20 -3.839 -9.507 3.405 157 HZ PHE 20 HZ PHE 20 -1.770 -10.662 2.704 158 H LYS 21 HN LYS 21 -6.529 -7.582 -2.513 159 HA LYS 21 HA LYS 21 -6.643 -5.403 -4.150 160 HB2 LYS 21 HB2 LYS 21 -7.381 -7.373 -5.054 161 HB3 LYS 21 HB1 LYS 21 -8.461 -7.700 -3.761 162 HG2 LYS 21 HG2 LYS 21 -9.563 -7.153 -5.908 163 HG3 LYS 21 HG1 LYS 21 -10.021 -6.119 -4.564 164 HD2 LYS 21 HD2 LYS 21 -8.010 -4.667 -5.561 165 HD3 LYS 21 HD1 LYS 21 -8.565 -5.466 -7.039 166 HE2 LYS 21 HE2 LYS 21 -10.672 -4.435 -5.275 167 HE3 LYS 21 HE1 LYS 21 -9.672 -3.200 -6.032 168 HZ1 LYS 21 HZ1 LYS 21 -11.265 -5.304 -7.371 169 HZ2 LYS 21 HZ2 LYS 21 -10.176 -4.295 -8.183 170 HZ3 LYS 21 HZ3 LYS 21 -11.534 -3.632 -7.422 171 H ALA 22 HN ALA 22 -9.020 -6.442 -1.853 172 HA ALA 22 HA ALA 22 -10.921 -4.584 -2.355 173 HB1 ALA 22 HB1 ALA 22 -11.788 -4.975 -0.101 174 HB2 ALA 22 HB2 ALA 22 -10.248 -5.694 0.374 175 HB3 ALA 22 HB3 ALA 22 -11.257 -6.486 -0.839 176 H ALA 23 HN ALA 23 -8.342 -4.325 0.090 177 HA ALA 23 HA ALA 23 -8.880 -1.769 0.993 178 HB1 ALA 23 HB1 ALA 23 -6.231 -3.170 0.710 179 HB2 ALA 23 HB2 ALA 23 -7.287 -3.161 2.122 180 HB3 ALA 23 HB3 ALA 23 -6.474 -1.679 1.615 181 H PHE 24 HN PHE 24 -6.884 -2.744 -1.774 182 HA PHE 24 HA PHE 24 -6.027 -0.305 -2.728 183 HB2 PHE 24 HB2 PHE 24 -5.478 -2.397 -3.828 184 HB3 PHE 24 HB1 PHE 24 -7.135 -2.633 -4.235 185 HD1 PHE 24 HD1 PHE 24 -7.479 -2.516 -6.467 186 HD2 PHE 24 HD2 PHE 24 -4.832 0.291 -4.673 187 HE1 PHE 24 HE1 PHE 24 -7.217 -1.384 -8.627 188 HE2 PHE 24 HE2 PHE 24 -4.569 1.429 -6.827 189 HZ PHE 24 HZ PHE 24 -5.765 0.591 -8.811 190 H ASP 25 HN ASP 25 -8.890 -1.991 -3.687 191 HA ASP 25 HA ASP 25 -10.123 -0.094 -5.301 192 HB2 ASP 25 HB2 ASP 25 -10.712 -2.597 -4.805 193 HB3 ASP 25 HB1 ASP 25 -11.758 -1.924 -3.607 194 H ILE 26 HN ILE 26 -10.392 -0.535 -1.853 195 HA ILE 26 HA ILE 26 -12.489 1.409 -1.516 196 HB ILE 26 HB ILE 26 -10.675 0.115 0.482 197 HG12 ILE 26 HG12 ILE 26 -13.457 -0.732 -0.223 198 HG13 ILE 26 HG11 ILE 26 -12.077 -1.338 -1.123 199 HG21 ILE 26 HG21 ILE 26 -12.045 2.170 1.166 200 HG22 ILE 26 HG22 ILE 26 -12.208 0.717 2.154 201 HG23 ILE 26 HG23 ILE 26 -13.454 1.123 0.976 202 HD11 ILE 26 HD11 ILE 26 -12.667 -1.744 1.791 203 HD12 ILE 26 HD12 ILE 26 -11.172 -2.232 0.984 204 HD13 ILE 26 HD13 ILE 26 -12.707 -2.936 0.491 205 H PHE 27 HN PHE 27 -9.036 1.270 -1.342 206 HA PHE 27 HA PHE 27 -8.443 3.769 -0.215 207 HB2 PHE 27 HB2 PHE 27 -7.110 1.668 -1.678 208 HB3 PHE 27 HB1 PHE 27 -6.642 3.219 -2.315 209 HD1 PHE 27 HD1 PHE 27 -6.278 0.893 0.290 210 HD2 PHE 27 HD2 PHE 27 -5.689 4.937 -0.813 211 HE1 PHE 27 HE1 PHE 27 -4.645 1.143 2.102 212 HE2 PHE 27 HE2 PHE 27 -4.077 5.206 1.011 213 HZ PHE 27 HZ PHE 27 -3.563 3.300 2.464 214 H VAL 28 HN VAL 28 -9.523 2.706 -3.316 215 HA VAL 28 HA VAL 28 -9.125 5.383 -4.434 216 HB VAL 28 HB VAL 28 -9.465 4.325 -6.666 217 HG11 VAL 28 HG11 VAL 28 -7.292 2.986 -5.099 218 HG12 VAL 28 HG12 VAL 28 -7.229 4.682 -5.597 219 HG13 VAL 28 HG13 VAL 28 -7.304 3.403 -6.812 220 HG21 VAL 28 HG21 VAL 28 -9.358 1.946 -6.890 221 HG22 VAL 28 HG22 VAL 28 -10.738 2.364 -5.871 222 HG23 VAL 28 HG23 VAL 28 -9.251 1.749 -5.145 223 H LEU 29 HN LEU 29 -11.393 4.531 -2.680 224 HA LEU 29 HA LEU 29 -13.757 4.446 -4.237 225 HB2 LEU 29 HB2 LEU 29 -13.408 5.668 -1.498 226 HB3 LEU 29 HB1 LEU 29 -14.935 5.251 -2.237 227 HG LEU 29 HG LEU 29 -12.803 3.313 -1.352 228 HD11 LEU 29 HD11 LEU 29 -15.535 3.925 -0.235 229 HD12 LEU 29 HD12 LEU 29 -13.990 4.353 0.499 230 HD13 LEU 29 HD13 LEU 29 -14.447 2.658 0.333 231 HD21 LEU 29 HD21 LEU 29 -14.498 1.595 -1.834 232 HD22 LEU 29 HD22 LEU 29 -13.939 2.427 -3.283 233 HD23 LEU 29 HD23 LEU 29 -15.511 2.828 -2.587 234 H GLY 30 HN GLY 30 -14.390 5.935 -5.617 235 HA2 GLY 30 HA2 GLY 30 -15.096 8.080 -6.238 236 HA3 GLY 30 HA1 GLY 30 -14.172 8.753 -4.905 237 H ALA 31 HN ALA 31 -12.242 6.555 -6.500 238 HA ALA 31 HA ALA 31 -10.733 8.659 -7.788 239 HB1 ALA 31 HB1 ALA 31 -9.581 6.831 -6.608 240 HB2 ALA 31 HB2 ALA 31 -9.105 6.923 -8.305 241 HB3 ALA 31 HB3 ALA 31 -10.238 5.683 -7.773 242 H GLU 32 HN GLU 32 -10.591 9.062 -9.919 243 HA GLU 32 HA GLU 32 -12.750 8.111 -11.539 244 HB2 GLU 32 HB2 GLU 32 -10.482 10.010 -12.095 245 HB3 GLU 32 HB1 GLU 32 -11.753 9.641 -13.256 246 HG2 GLU 32 HG2 GLU 32 -12.227 10.754 -10.513 247 HG3 GLU 32 HG1 GLU 32 -12.135 11.730 -11.979 248 H ASP 33 HN ASP 33 -9.363 7.370 -11.218 249 HA ASP 33 HA ASP 33 -9.530 5.664 -13.592 250 HB2 ASP 33 HB2 ASP 33 -7.653 7.243 -13.563 251 HB3 ASP 33 HB1 ASP 33 -7.102 6.521 -12.063 252 H GLY 34 HN GLY 34 -9.471 5.641 -10.215 253 HA2 GLY 34 HA2 GLY 34 -9.802 3.907 -8.744 254 HA3 GLY 34 HA1 GLY 34 -9.871 2.811 -10.115 255 H SER 35 HN SER 35 -7.121 4.727 -10.147 256 HA SER 35 HA SER 35 -5.517 2.686 -8.755 257 HB2 SER 35 HB2 SER 35 -3.580 3.689 -9.965 258 HB3 SER 35 HB1 SER 35 -4.815 3.129 -11.058 259 HG SER 35 HG SER 35 -5.167 5.057 -11.748 260 H ILE 36 HN ILE 36 -4.017 3.519 -7.129 261 HA ILE 36 HA ILE 36 -5.336 5.536 -5.558 262 HB ILE 36 HB ILE 36 -2.825 3.918 -5.120 263 HG12 ILE 36 HG12 ILE 36 -5.341 4.046 -3.480 264 HG13 ILE 36 HG11 ILE 36 -5.102 2.885 -4.792 265 HG21 ILE 36 HG21 ILE 36 -2.042 5.451 -3.717 266 HG22 ILE 36 HG22 ILE 36 -3.456 5.162 -2.698 267 HG23 ILE 36 HG23 ILE 36 -3.490 6.437 -3.914 268 HD11 ILE 36 HD11 ILE 36 -3.841 3.029 -2.110 269 HD12 ILE 36 HD12 ILE 36 -2.924 2.324 -3.439 270 HD13 ILE 36 HD13 ILE 36 -4.487 1.639 -2.985 271 H SER 37 HN SER 37 -5.134 7.553 -6.254 272 HA SER 37 HA SER 37 -2.555 8.608 -7.007 273 HB2 SER 37 HB2 SER 37 -3.677 10.683 -7.353 274 HB3 SER 37 HB1 SER 37 -4.761 9.427 -7.938 275 HG SER 37 HG SER 37 -6.181 9.979 -6.472 276 H THR 38 HN THR 38 -2.113 10.846 -5.679 277 HA THR 38 HA THR 38 -1.274 9.777 -3.219 278 HB THR 38 HB THR 38 -0.559 12.231 -2.819 279 HG1 THR 38 HG1 THR 38 -0.410 12.736 -5.435 280 HG21 THR 38 HG21 THR 38 0.493 10.555 -5.107 281 HG22 THR 38 HG22 THR 38 0.913 10.355 -3.403 282 HG23 THR 38 HG23 THR 38 1.384 11.822 -4.264 283 H LYS 39 HN LYS 39 -3.962 11.954 -4.044 284 HA LYS 39 HA LYS 39 -4.506 12.242 -1.232 285 HB2 LYS 39 HB2 LYS 39 -5.148 13.903 -3.184 286 HB3 LYS 39 HB1 LYS 39 -6.640 12.985 -3.063 287 HG2 LYS 39 HG2 LYS 39 -6.209 15.102 -1.579 288 HG3 LYS 39 HG1 LYS 39 -7.116 13.730 -0.961 289 HD2 LYS 39 HD2 LYS 39 -5.207 12.922 0.207 290 HD3 LYS 39 HD1 LYS 39 -4.143 14.072 -0.603 291 HE2 LYS 39 HE2 LYS 39 -6.357 14.759 1.316 292 HE3 LYS 39 HE1 LYS 39 -4.641 14.681 1.722 293 HZ1 LYS 39 HZ1 LYS 39 -4.298 16.426 -0.020 294 HZ2 LYS 39 HZ2 LYS 39 -5.180 16.943 1.323 295 HZ3 LYS 39 HZ3 LYS 39 -5.978 16.590 -0.123 296 H GLU 40 HN GLU 40 -5.664 10.199 -3.839 297 HA GLU 40 HA GLU 40 -7.693 8.825 -2.503 298 HB2 GLU 40 HB2 GLU 40 -5.666 8.129 -4.571 299 HB3 GLU 40 HB1 GLU 40 -6.418 6.784 -3.730 300 HG2 GLU 40 HG2 GLU 40 -7.464 7.488 -5.907 301 HG3 GLU 40 HG1 GLU 40 -8.541 7.321 -4.532 302 H LEU 41 HN LEU 41 -4.217 8.367 -2.483 303 HA LEU 41 HA LEU 41 -4.000 6.403 -0.506 304 HB2 LEU 41 HB2 LEU 41 -2.194 7.018 -2.045 305 HB3 LEU 41 HB1 LEU 41 -2.078 8.595 -1.307 306 HG LEU 41 HG LEU 41 -1.116 7.728 0.656 307 HD11 LEU 41 HD11 LEU 41 -2.391 5.851 1.169 308 HD12 LEU 41 HD12 LEU 41 -0.809 5.186 0.807 309 HD13 LEU 41 HD13 LEU 41 -2.095 5.106 -0.392 310 HD21 LEU 41 HD21 LEU 41 0.242 7.827 -1.471 311 HD22 LEU 41 HD22 LEU 41 0.055 6.073 -1.563 312 HD23 LEU 41 HD23 LEU 41 0.888 6.802 -0.192 313 H GLY 42 HN GLY 42 -3.901 9.940 -0.334 314 HA2 GLY 42 HA2 GLY 42 -3.269 10.246 2.362 315 HA3 GLY 42 HA1 GLY 42 -4.080 11.443 1.372 316 H LYS 43 HN LYS 43 -6.361 9.889 0.756 317 HA LYS 43 HA LYS 43 -8.094 10.572 2.804 318 HB2 LYS 43 HB2 LYS 43 -9.028 10.176 0.669 319 HB3 LYS 43 HB1 LYS 43 -8.253 8.611 0.521 320 HG2 LYS 43 HG2 LYS 43 -9.886 8.222 2.675 321 HG3 LYS 43 HG1 LYS 43 -10.837 9.323 1.671 322 HD2 LYS 43 HD2 LYS 43 -10.411 7.827 -0.266 323 HD3 LYS 43 HD1 LYS 43 -9.614 6.701 0.825 324 HE2 LYS 43 HE2 LYS 43 -11.841 5.936 0.467 325 HE3 LYS 43 HE1 LYS 43 -11.737 6.552 2.115 326 HZ1 LYS 43 HZ1 LYS 43 -13.757 7.294 1.048 327 HZ2 LYS 43 HZ2 LYS 43 -12.881 7.998 -0.214 328 HZ3 LYS 43 HZ3 LYS 43 -12.751 8.615 1.356 329 H VAL 44 HN VAL 44 -6.592 7.423 2.149 330 HA VAL 44 HA VAL 44 -7.847 6.149 4.379 331 HB VAL 44 HB VAL 44 -5.485 5.371 2.701 332 HG11 VAL 44 HG11 VAL 44 -6.885 3.696 4.805 333 HG12 VAL 44 HG12 VAL 44 -5.283 4.410 4.991 334 HG13 VAL 44 HG13 VAL 44 -5.557 3.170 3.761 335 HG21 VAL 44 HG21 VAL 44 -7.063 3.710 1.853 336 HG22 VAL 44 HG22 VAL 44 -7.627 5.364 1.575 337 HG23 VAL 44 HG23 VAL 44 -8.311 4.408 2.895 338 H MET 45 HN MET 45 -4.634 7.467 3.749 339 HA MET 45 HA MET 45 -3.425 6.874 6.157 340 HB2 MET 45 HB2 MET 45 -3.226 9.347 4.447 341 HB3 MET 45 HB1 MET 45 -2.130 8.973 5.771 342 HG2 MET 45 HG2 MET 45 -2.529 6.898 3.742 343 HG3 MET 45 HG1 MET 45 -1.637 8.317 3.257 344 HE1 MET 45 HE1 MET 45 1.413 8.383 5.395 345 HE2 MET 45 HE2 MET 45 -0.069 9.071 6.074 346 HE3 MET 45 HE3 MET 45 0.268 9.221 4.351 347 H ARG 46 HN ARG 46 -5.532 9.684 5.386 348 HA ARG 46 HA ARG 46 -5.507 10.694 8.016 349 HB2 ARG 46 HB2 ARG 46 -6.998 11.180 5.537 350 HB3 ARG 46 HB1 ARG 46 -7.801 11.648 7.016 351 HG2 ARG 46 HG2 ARG 46 -6.619 13.508 7.018 352 HG3 ARG 46 HG1 ARG 46 -5.179 12.534 7.292 353 HD2 ARG 46 HD2 ARG 46 -4.732 13.794 5.400 354 HD3 ARG 46 HD1 ARG 46 -5.114 12.198 4.792 355 HE ARG 46 HE ARG 46 -7.232 13.022 4.078 356 HH11 ARG 46 HH11 ARG 46 -5.042 15.528 5.203 357 HH12 ARG 46 HH12 ARG 46 -5.896 16.805 4.405 358 HH21 ARG 46 HH21 ARG 46 -8.352 14.708 3.023 359 HH22 ARG 46 HH22 ARG 46 -7.782 16.345 3.165 360 H MET 47 HN MET 47 -7.345 8.211 6.424 361 HA MET 47 HA MET 47 -9.344 7.852 8.365 362 HB2 MET 47 HB2 MET 47 -8.210 6.362 6.097 363 HB3 MET 47 HB1 MET 47 -9.265 5.517 7.165 364 HG2 MET 47 HG2 MET 47 -10.707 7.741 6.688 365 HG3 MET 47 HG1 MET 47 -9.835 7.571 5.179 366 HE1 MET 47 HE1 MET 47 -9.902 5.249 3.737 367 HE2 MET 47 HE2 MET 47 -10.852 3.848 4.245 368 HE3 MET 47 HE3 MET 47 -9.484 4.393 5.216 369 H LEU 48 HN LEU 48 -6.024 7.274 8.316 370 HA LEU 48 HA LEU 48 -6.147 5.170 10.357 371 HB2 LEU 48 HB2 LEU 48 -3.809 6.057 8.734 372 HB3 LEU 48 HB1 LEU 48 -3.883 4.654 9.768 373 HG LEU 48 HG LEU 48 -5.507 5.053 7.272 374 HD11 LEU 48 HD11 LEU 48 -3.152 4.763 6.787 375 HD12 LEU 48 HD12 LEU 48 -4.062 3.324 6.332 376 HD13 LEU 48 HD13 LEU 48 -3.099 3.330 7.810 377 HD21 LEU 48 HD21 LEU 48 -5.198 2.652 9.060 378 HD22 LEU 48 HD22 LEU 48 -6.151 2.737 7.581 379 HD23 LEU 48 HD23 LEU 48 -6.618 3.694 8.985 380 H GLY 49 HN GLY 49 -6.353 8.251 10.602 381 HA2 GLY 49 HA2 GLY 49 -5.743 9.702 12.312 382 HA3 GLY 49 HA1 GLY 49 -4.678 8.455 12.934 383 H GLN 50 HN GLN 50 -3.927 8.820 9.745 384 HA GLN 50 HA GLN 50 -1.569 10.384 10.340 385 HB2 GLN 50 HB2 GLN 50 -2.564 9.247 7.732 386 HB3 GLN 50 HB1 GLN 50 -0.965 9.932 7.989 387 HG2 GLN 50 HG2 GLN 50 -2.118 7.402 9.170 388 HG3 GLN 50 HG1 GLN 50 -0.815 7.520 7.995 389 HE21 GLN 50 HE21 GLN 50 -0.864 6.199 10.573 390 HE22 GLN 50 HE22 GLN 50 0.407 6.901 11.511 391 H ASN 51 HN ASN 51 -0.990 12.279 8.998 392 HA ASN 51 HA ASN 51 -3.177 13.430 7.460 393 HB2 ASN 51 HB2 ASN 51 -2.921 15.649 8.438 394 HB3 ASN 51 HB1 ASN 51 -3.425 14.477 9.646 395 HD21 ASN 51 HD21 ASN 51 -2.143 17.056 9.918 396 HD22 ASN 51 HD22 ASN 51 -0.699 16.786 10.830 397 HA PRO 52 HA PRO 52 1.043 13.293 5.426 398 HB2 PRO 52 HB2 PRO 52 -0.209 12.620 3.069 399 HB3 PRO 52 HB1 PRO 52 0.557 11.504 4.158 400 HG2 PRO 52 HG2 PRO 52 -2.306 12.192 3.836 401 HG3 PRO 52 HG1 PRO 52 -1.580 10.625 4.210 402 HD2 PRO 52 HD2 PRO 52 -2.775 12.068 6.102 403 HD3 PRO 52 HD1 PRO 52 -1.308 11.156 6.442 404 H THR 53 HN THR 53 1.850 14.610 3.816 405 HA THR 53 HA THR 53 -0.119 16.188 2.350 406 HB THR 53 HB THR 53 1.873 17.511 1.533 407 HG1 THR 53 HG1 THR 53 3.168 15.936 3.528 408 HG21 THR 53 HG21 THR 53 0.470 18.368 3.325 409 HG22 THR 53 HG22 THR 53 2.159 18.773 3.630 410 HG23 THR 53 HG23 THR 53 1.396 17.450 4.509 411 HA PRO 54 HA PRO 54 0.171 13.799 -1.282 412 HB2 PRO 54 HB2 PRO 54 0.931 16.318 -2.629 413 HB3 PRO 54 HB1 PRO 54 -0.270 15.120 -3.097 414 HG2 PRO 54 HG2 PRO 54 -1.058 17.315 -1.955 415 HG3 PRO 54 HG1 PRO 54 -1.729 15.789 -1.421 416 HD2 PRO 54 HD2 PRO 54 0.358 17.497 -0.144 417 HD3 PRO 54 HD1 PRO 54 -1.002 16.638 0.610 418 H GLU 55 HN GLU 55 2.798 16.108 -0.810 419 HA GLU 55 HA GLU 55 4.834 15.119 -2.332 420 HB2 GLU 55 HB2 GLU 55 4.811 16.172 0.465 421 HB3 GLU 55 HB1 GLU 55 6.262 15.950 -0.468 422 HG2 GLU 55 HG2 GLU 55 3.977 17.602 -1.312 423 HG3 GLU 55 HG1 GLU 55 5.380 18.232 -0.506 424 H GLU 56 HN GLU 56 4.046 14.212 0.951 425 HA GLU 56 HA GLU 56 5.853 12.138 1.325 426 HB2 GLU 56 HB2 GLU 56 3.115 12.496 2.521 427 HB3 GLU 56 HB1 GLU 56 4.484 11.706 3.249 428 HG2 GLU 56 HG2 GLU 56 5.701 13.896 3.086 429 HG3 GLU 56 HG1 GLU 56 4.162 14.575 2.629 430 H LEU 57 HN LEU 57 2.427 11.985 0.875 431 HA LEU 57 HA LEU 57 1.915 9.375 0.369 432 HB2 LEU 57 HB2 LEU 57 0.715 11.768 -0.977 433 HB3 LEU 57 HB1 LEU 57 -0.004 10.170 -0.961 434 HG LEU 57 HG LEU 57 0.701 11.486 1.626 435 HD11 LEU 57 HD11 LEU 57 -1.713 12.302 1.625 436 HD12 LEU 57 HD12 LEU 57 -1.636 12.149 -0.133 437 HD13 LEU 57 HD13 LEU 57 -0.536 13.242 0.713 438 HD21 LEU 57 HD21 LEU 57 0.003 9.137 1.549 439 HD22 LEU 57 HD22 LEU 57 -1.514 9.624 0.806 440 HD23 LEU 57 HD23 LEU 57 -1.131 10.143 2.443 441 H GLN 58 HN GLN 58 3.257 11.686 -1.901 442 HA GLN 58 HA GLN 58 3.060 10.073 -4.190 443 HB2 GLN 58 HB2 GLN 58 3.510 12.504 -4.266 444 HB3 GLN 58 HB1 GLN 58 5.100 12.221 -3.567 445 HG2 GLN 58 HG2 GLN 58 5.695 10.868 -5.525 446 HG3 GLN 58 HG1 GLN 58 4.121 11.228 -6.232 447 HE21 GLN 58 HE21 GLN 58 7.246 12.510 -5.391 448 HE22 GLN 58 HE22 GLN 58 7.103 13.982 -6.292 449 H GLU 59 HN GLU 59 5.678 10.522 -1.823 450 HA GLU 59 HA GLU 59 7.573 8.856 -2.942 451 HB2 GLU 59 HB2 GLU 59 6.974 9.371 -0.094 452 HB3 GLU 59 HB1 GLU 59 8.466 8.668 -0.661 453 HG2 GLU 59 HG2 GLU 59 7.453 11.371 -1.493 454 HG3 GLU 59 HG1 GLU 59 8.547 11.113 -0.144 455 H MET 60 HN MET 60 4.812 8.069 -0.926 456 HA MET 60 HA MET 60 5.430 5.368 -0.439 457 HB2 MET 60 HB2 MET 60 2.663 6.384 -0.742 458 HB3 MET 60 HB1 MET 60 3.222 5.098 0.289 459 HG2 MET 60 HG2 MET 60 4.629 7.213 1.208 460 HG3 MET 60 HG1 MET 60 3.105 7.960 0.767 461 HE1 MET 60 HE1 MET 60 0.772 7.152 1.653 462 HE2 MET 60 HE2 MET 60 0.553 5.904 2.888 463 HE3 MET 60 HE3 MET 60 1.098 5.461 1.272 464 H ILE 61 HN ILE 61 3.293 6.852 -2.795 465 HA ILE 61 HA ILE 61 2.682 4.633 -4.350 466 HB ILE 61 HB ILE 61 2.817 7.559 -4.950 467 HG12 ILE 61 HG12 ILE 61 0.666 5.517 -4.430 468 HG13 ILE 61 HG11 ILE 61 1.134 6.865 -3.401 469 HG21 ILE 61 HG21 ILE 61 3.220 6.293 -7.061 470 HG22 ILE 61 HG22 ILE 61 1.697 7.188 -7.040 471 HG23 ILE 61 HG23 ILE 61 1.697 5.440 -6.784 472 HD11 ILE 61 HD11 ILE 61 0.336 8.398 -5.125 473 HD12 ILE 61 HD12 ILE 61 -0.924 7.333 -4.509 474 HD13 ILE 61 HD13 ILE 61 -0.181 7.006 -6.071 475 H ASP 62 HN ASP 62 5.369 6.892 -4.517 476 HA ASP 62 HA ASP 62 6.444 6.266 -6.990 477 HB2 ASP 62 HB2 ASP 62 7.134 8.207 -5.680 478 HB3 ASP 62 HB1 ASP 62 7.863 7.153 -4.475 479 H GLU 63 HN GLU 63 6.949 4.647 -3.905 480 HA GLU 63 HA GLU 63 9.192 3.122 -4.417 481 HB2 GLU 63 HB2 GLU 63 7.984 3.248 -2.270 482 HB3 GLU 63 HB1 GLU 63 6.754 2.208 -2.960 483 HG2 GLU 63 HG2 GLU 63 8.332 0.985 -1.570 484 HG3 GLU 63 HG1 GLU 63 8.344 0.422 -3.234 485 H VAL 64 HN VAL 64 5.839 2.336 -5.092 486 HA VAL 64 HA VAL 64 6.630 -0.118 -6.461 487 HB VAL 64 HB VAL 64 4.311 -0.740 -6.339 488 HG11 VAL 64 HG11 VAL 64 3.945 -0.669 -3.915 489 HG12 VAL 64 HG12 VAL 64 5.216 0.540 -3.763 490 HG13 VAL 64 HG13 VAL 64 5.609 -1.090 -4.309 491 HG21 VAL 64 HG21 VAL 64 3.348 1.415 -6.841 492 HG22 VAL 64 HG22 VAL 64 3.875 2.029 -5.278 493 HG23 VAL 64 HG23 VAL 64 2.647 0.759 -5.360 494 H ASP 65 HN ASP 65 5.882 3.051 -7.124 495 HA ASP 65 HA ASP 65 4.189 2.905 -9.365 496 HB2 ASP 65 HB2 ASP 65 4.452 4.914 -7.994 497 HB3 ASP 65 HB1 ASP 65 6.117 5.022 -8.489 498 H GLU 66 HN GLU 66 5.176 1.223 -10.645 499 HA GLU 66 HA GLU 66 7.751 1.472 -11.763 500 HB2 GLU 66 HB2 GLU 66 5.359 -0.164 -12.515 501 HB3 GLU 66 HB1 GLU 66 6.929 -0.343 -13.241 502 HG2 GLU 66 HG2 GLU 66 7.882 -1.057 -11.152 503 HG3 GLU 66 HG1 GLU 66 6.359 -0.723 -10.323 504 H ASP 67 HN ASP 67 4.502 2.356 -12.809 505 HA ASP 67 HA ASP 67 5.334 2.884 -15.530 506 HB2 ASP 67 HB2 ASP 67 3.087 1.990 -15.003 507 HB3 ASP 67 HB1 ASP 67 2.719 3.458 -14.115 508 H GLY 68 HN GLY 68 5.567 4.528 -12.659 509 HA2 GLY 68 HA2 GLY 68 5.993 6.706 -12.081 510 HA3 GLY 68 HA1 GLY 68 6.385 6.982 -13.775 511 H SER 69 HN SER 69 3.298 5.846 -12.575 512 HA SER 69 HA SER 69 1.998 7.944 -14.098 513 HB2 SER 69 HB2 SER 69 1.281 5.563 -14.259 514 HB3 SER 69 HB1 SER 69 0.790 5.624 -12.569 515 HG SER 69 HG SER 69 -1.020 6.428 -13.228 516 H GLY 70 HN GLY 70 2.893 7.365 -10.863 517 HA2 GLY 70 HA2 GLY 70 2.598 8.788 -9.033 518 HA3 GLY 70 HA1 GLY 70 1.469 9.736 -9.987 519 H THR 71 HN THR 71 0.748 6.560 -10.291 520 HA THR 71 HA THR 71 -1.057 6.523 -7.993 521 HB THR 71 HB THR 71 -2.669 5.254 -9.558 522 HG1 THR 71 HG1 THR 71 -1.205 4.978 -11.286 523 HG21 THR 71 HG21 THR 71 -3.785 7.218 -10.305 524 HG22 THR 71 HG22 THR 71 -2.306 8.174 -10.237 525 HG23 THR 71 HG23 THR 71 -3.059 7.609 -8.744 526 H VAL 72 HN VAL 72 -1.275 4.678 -6.991 527 HA VAL 72 HA VAL 72 0.168 2.353 -7.948 528 HB VAL 72 HB VAL 72 -1.237 3.077 -5.424 529 HG11 VAL 72 HG11 VAL 72 -2.183 0.851 -6.238 530 HG12 VAL 72 HG12 VAL 72 -1.346 0.794 -4.690 531 HG13 VAL 72 HG13 VAL 72 -0.538 0.216 -6.139 532 HG21 VAL 72 HG21 VAL 72 1.327 1.748 -6.170 533 HG22 VAL 72 HG22 VAL 72 0.846 2.164 -4.539 534 HG23 VAL 72 HG23 VAL 72 1.117 3.441 -5.740 535 H ASP 73 HN ASP 73 -0.722 0.758 -9.038 536 HA ASP 73 HA ASP 73 -3.660 0.577 -8.915 537 HB2 ASP 73 HB2 ASP 73 -2.519 0.910 -11.171 538 HB3 ASP 73 HB1 ASP 73 -1.866 -0.692 -10.967 539 H PHE 74 HN PHE 74 -4.110 -2.045 -9.380 540 HA PHE 74 HA PHE 74 -4.061 -2.779 -6.735 541 HB2 PHE 74 HB2 PHE 74 -5.716 -3.687 -8.141 542 HB3 PHE 74 HB1 PHE 74 -4.522 -4.417 -9.206 543 HD1 PHE 74 HD1 PHE 74 -5.094 -6.654 -9.142 544 HD2 PHE 74 HD2 PHE 74 -4.601 -4.518 -5.495 545 HE1 PHE 74 HE1 PHE 74 -5.229 -8.760 -7.889 546 HE2 PHE 74 HE2 PHE 74 -4.724 -6.633 -4.242 547 HZ PHE 74 HZ PHE 74 -5.056 -8.751 -5.439 548 H ASP 75 HN ASP 75 -1.937 -4.209 -9.265 549 HA ASP 75 HA ASP 75 -0.705 -5.981 -7.441 550 HB2 ASP 75 HB2 ASP 75 0.818 -6.466 -9.226 551 HB3 ASP 75 HB1 ASP 75 -0.809 -6.361 -9.872 552 H GLU 76 HN GLU 76 0.030 -2.745 -8.530 553 HA GLU 76 HA GLU 76 2.547 -2.429 -7.427 554 HB2 GLU 76 HB2 GLU 76 0.400 -0.417 -7.613 555 HB3 GLU 76 HB1 GLU 76 2.080 -0.081 -7.469 556 HG2 GLU 76 HG2 GLU 76 2.354 -1.379 -9.647 557 HG3 GLU 76 HG1 GLU 76 0.611 -1.275 -9.746 558 H PHE 77 HN PHE 77 -0.540 -1.623 -6.088 559 HA PHE 77 HA PHE 77 0.049 -1.045 -3.447 560 HB2 PHE 77 HB2 PHE 77 -2.206 -0.972 -4.640 561 HB3 PHE 77 HB1 PHE 77 -2.321 -2.698 -4.351 562 HD1 PHE 77 HD1 PHE 77 -3.506 -3.383 -2.549 563 HD2 PHE 77 HD2 PHE 77 -1.649 0.439 -2.458 564 HE1 PHE 77 HE1 PHE 77 -4.520 -2.945 -0.350 565 HE2 PHE 77 HE2 PHE 77 -2.657 0.882 -0.259 566 HZ PHE 77 HZ PHE 77 -4.101 -0.820 0.796 567 H LEU 78 HN LEU 78 -0.432 -4.120 -4.986 568 HA LEU 78 HA LEU 78 -0.830 -5.660 -2.662 569 HB2 LEU 78 HB2 LEU 78 -1.646 -6.109 -4.952 570 HB3 LEU 78 HB1 LEU 78 -0.015 -6.476 -5.443 571 HG LEU 78 HG LEU 78 0.003 -8.514 -4.338 572 HD11 LEU 78 HD11 LEU 78 -1.649 -9.156 -2.698 573 HD12 LEU 78 HD12 LEU 78 -2.312 -7.516 -2.759 574 HD13 LEU 78 HD13 LEU 78 -0.666 -7.780 -2.172 575 HD21 LEU 78 HD21 LEU 78 -2.909 -8.223 -4.849 576 HD22 LEU 78 HD22 LEU 78 -1.908 -9.678 -4.954 577 HD23 LEU 78 HD23 LEU 78 -1.723 -8.390 -6.156 578 H VAL 79 HN VAL 79 2.104 -5.061 -4.574 579 HA VAL 79 HA VAL 79 3.735 -6.870 -3.082 580 HB VAL 79 HB VAL 79 4.223 -4.662 -4.980 581 HG11 VAL 79 HG11 VAL 79 6.210 -5.526 -2.940 582 HG12 VAL 79 HG12 VAL 79 5.897 -3.912 -3.573 583 HG13 VAL 79 HG13 VAL 79 6.744 -5.101 -4.560 584 HG21 VAL 79 HG21 VAL 79 5.659 -6.385 -5.988 585 HG22 VAL 79 HG22 VAL 79 3.956 -6.844 -5.820 586 HG23 VAL 79 HG23 VAL 79 5.160 -7.463 -4.682 587 H MET 80 HN MET 80 3.187 -3.362 -2.871 588 HA MET 80 HA MET 80 4.856 -3.056 -0.636 589 HB2 MET 80 HB2 MET 80 4.191 -1.131 -1.941 590 HB3 MET 80 HB1 MET 80 2.491 -1.412 -1.573 591 HG2 MET 80 HG2 MET 80 3.418 0.399 -0.257 592 HG3 MET 80 HG1 MET 80 2.904 -0.941 0.766 593 HE1 MET 80 HE1 MET 80 5.886 -0.273 3.004 594 HE2 MET 80 HE2 MET 80 4.279 -0.989 2.890 595 HE3 MET 80 HE3 MET 80 4.513 0.714 2.507 596 H MET 81 HN MET 81 1.486 -4.040 -1.017 597 HA MET 81 HA MET 81 0.635 -4.161 1.545 598 HB2 MET 81 HB2 MET 81 0.326 -5.895 -0.832 599 HB3 MET 81 HB1 MET 81 -0.371 -6.376 0.667 600 HG2 MET 81 HG2 MET 81 -1.021 -3.998 -0.966 601 HG3 MET 81 HG1 MET 81 -2.073 -5.314 -0.493 602 HE1 MET 81 HE1 MET 81 -0.918 -5.315 2.847 603 HE2 MET 81 HE2 MET 81 -2.363 -5.925 2.046 604 HE3 MET 81 HE3 MET 81 -2.511 -4.725 3.323 605 H VAL 82 HN VAL 82 2.407 -6.740 -0.171 606 HA VAL 82 HA VAL 82 2.974 -8.449 1.930 607 HB VAL 82 HB VAL 82 5.098 -7.807 -0.087 608 HG11 VAL 82 HG11 VAL 82 5.271 -10.270 -0.086 609 HG12 VAL 82 HG12 VAL 82 4.092 -10.287 1.226 610 HG13 VAL 82 HG13 VAL 82 5.651 -9.491 1.448 611 HG21 VAL 82 HG21 VAL 82 2.937 -7.868 -1.283 612 HG22 VAL 82 HG22 VAL 82 2.749 -9.528 -0.709 613 HG23 VAL 82 HG23 VAL 82 4.100 -9.101 -1.757 614 H ARG 83 HN ARG 83 4.848 -5.805 0.628 615 HA ARG 83 HA ARG 83 7.002 -5.838 2.367 616 HB2 ARG 83 HB2 ARG 83 6.737 -4.582 0.208 617 HB3 ARG 83 HB1 ARG 83 5.788 -3.409 1.111 618 HG2 ARG 83 HG2 ARG 83 7.763 -3.145 2.633 619 HG3 ARG 83 HG1 ARG 83 8.664 -4.090 1.447 620 HD2 ARG 83 HD2 ARG 83 8.437 -2.476 -0.210 621 HD3 ARG 83 HD1 ARG 83 7.131 -1.660 0.650 622 HE ARG 83 HE ARG 83 8.925 -1.115 2.353 623 HH11 ARG 83 HH11 ARG 83 9.617 -1.595 -1.042 624 HH12 ARG 83 HH12 ARG 83 10.976 -0.515 -1.033 625 HH21 ARG 83 HH21 ARG 83 10.722 0.284 2.367 626 HH22 ARG 83 HH22 ARG 83 11.600 0.550 0.899 627 H SER 84 HN SER 84 3.819 -4.480 2.739 628 HA SER 84 HA SER 84 4.463 -2.807 4.965 629 HB2 SER 84 HB2 SER 84 2.572 -2.458 3.309 630 HB3 SER 84 HB1 SER 84 1.719 -3.767 4.126 631 HG SER 84 HG SER 84 2.540 -1.278 5.211 632 H MET 85 HN MET 85 3.138 -6.043 4.529 633 HA MET 85 HA MET 85 2.768 -6.364 7.387 634 HB2 MET 85 HB2 MET 85 1.939 -8.596 6.845 635 HB3 MET 85 HB1 MET 85 1.127 -7.370 5.889 636 HG2 MET 85 HG2 MET 85 2.850 -7.924 4.102 637 HG3 MET 85 HG1 MET 85 3.172 -9.366 5.047 638 HE1 MET 85 HE1 MET 85 -0.173 -7.439 4.425 639 HE2 MET 85 HE2 MET 85 -0.888 -8.377 3.114 640 HE3 MET 85 HE3 MET 85 0.580 -7.441 2.828 641 H LYS 86 HN LYS 86 5.075 -7.061 4.945 642 HA LYS 86 HA LYS 86 6.692 -8.721 6.670 643 HB2 LYS 86 HB2 LYS 86 6.613 -8.058 3.798 644 HB3 LYS 86 HB1 LYS 86 8.214 -8.364 4.477 645 HG2 LYS 86 HG2 LYS 86 7.484 -10.415 3.651 646 HG3 LYS 86 HG1 LYS 86 7.205 -10.516 5.388 647 HD2 LYS 86 HD2 LYS 86 4.864 -9.974 5.065 648 HD3 LYS 86 HD1 LYS 86 5.114 -9.816 3.320 649 HE2 LYS 86 HE2 LYS 86 5.678 -12.140 3.146 650 HE3 LYS 86 HE1 LYS 86 5.632 -12.333 4.898 651 HZ1 LYS 86 HZ1 LYS 86 3.619 -13.167 3.835 652 HZ2 LYS 86 HZ2 LYS 86 3.301 -11.641 3.192 653 HZ3 LYS 86 HZ3 LYS 86 3.266 -11.875 4.865 654 H ASP 87 HN ASP 87 6.078 -5.752 6.978 655 HA ASP 87 HA ASP 87 8.295 -4.180 6.345 656 HB2 ASP 87 HB2 ASP 87 6.207 -3.134 6.809 657 HB3 ASP 87 HB1 ASP 87 6.118 -3.866 8.405 658 H ASP 88 HN ASP 88 7.404 -5.321 9.633 659 HA ASP 88 HA ASP 88 9.903 -4.484 10.712 660 HB2 ASP 88 HB2 ASP 88 7.733 -6.253 11.823 661 HB3 ASP 88 HB1 ASP 88 9.210 -5.895 12.706 662 H SER 89 HN SER 89 8.840 -7.328 9.126 663 HA SER 89 HA SER 89 10.994 -8.941 10.178 664 HB2 SER 89 HB2 SER 89 10.022 -10.666 8.567 665 HB3 SER 89 HB1 SER 89 8.967 -10.130 9.874 666 HG SER 89 HG SER 89 8.880 -8.734 7.450 667 H LYS 90 HN LYS 90 11.245 -6.505 8.271 668 HA LYS 90 HA LYS 90 12.707 -7.668 6.066 669 HB2 LYS 90 HB2 LYS 90 11.614 -5.111 6.694 670 HB3 LYS 90 HB1 LYS 90 13.335 -4.902 6.413 671 HG2 LYS 90 HG2 LYS 90 11.399 -6.215 4.519 672 HG3 LYS 90 HG1 LYS 90 12.036 -4.577 4.380 673 HD2 LYS 90 HD2 LYS 90 14.302 -5.471 4.166 674 HD3 LYS 90 HD1 LYS 90 13.677 -7.112 4.325 675 HE2 LYS 90 HE2 LYS 90 12.383 -6.834 2.285 676 HE3 LYS 90 HE1 LYS 90 12.942 -5.169 2.140 677 HZ1 LYS 90 HZ1 LYS 90 14.183 -6.676 0.704 678 HZ2 LYS 90 HZ2 LYS 90 14.683 -7.573 2.047 679 HZ3 LYS 90 HZ3 LYS 90 15.192 -5.973 1.866 680 H GLY 136 HN GLY 136 13.879 -8.881 7.950 681 HA2 GLY 136 HA2 GLY 136 15.977 -9.300 8.826 682 HA3 GLY 136 HA1 GLY 136 16.516 -7.755 8.181 683 H LYS 137 HN LYS 137 13.681 -7.601 10.017 684 HA LYS 137 HA LYS 137 13.133 -6.609 11.972 685 HB2 LYS 137 HB2 LYS 137 15.718 -7.924 12.757 686 HB3 LYS 137 HB1 LYS 137 14.818 -6.936 13.897 687 HG2 LYS 137 HG2 LYS 137 13.748 -9.375 12.488 688 HG3 LYS 137 HG1 LYS 137 14.335 -9.325 14.152 689 HD2 LYS 137 HD2 LYS 137 12.606 -7.629 14.665 690 HD3 LYS 137 HD1 LYS 137 11.989 -7.800 13.021 691 HE2 LYS 137 HE2 LYS 137 11.469 -10.133 13.433 692 HE3 LYS 137 HE1 LYS 137 12.157 -10.018 15.054 693 HZ1 LYS 137 HZ1 LYS 137 9.784 -9.831 15.174 694 HZ2 LYS 137 HZ2 LYS 137 9.769 -8.580 14.042 695 HZ3 LYS 137 HZ3 LYS 137 10.462 -8.332 15.566 696 H PHE 138 HN PHE 138 14.793 -5.201 9.923 697 HA PHE 138 HA PHE 138 15.220 -2.796 11.386 698 HB2 PHE 138 HB2 PHE 138 17.268 -3.986 12.008 699 HB3 PHE 138 HB1 PHE 138 17.644 -4.248 10.310 700 HD1 PHE 138 HD1 PHE 138 18.898 -2.681 9.135 701 HD2 PHE 138 HD2 PHE 138 17.106 -1.588 12.829 702 HE1 PHE 138 HE1 PHE 138 20.117 -0.546 9.086 703 HE2 PHE 138 HE2 PHE 138 18.322 0.553 12.792 704 HZ PHE 138 HZ PHE 138 19.830 1.073 10.916 705 H LYS 139 HN LYS 139 14.506 -1.328 10.045 706 HA LYS 139 HA LYS 139 15.457 -1.218 7.326 707 HB2 LYS 139 HB2 LYS 139 13.285 -1.169 6.265 708 HB3 LYS 139 HB1 LYS 139 13.461 -2.680 7.138 709 HG2 LYS 139 HG2 LYS 139 11.903 -0.292 8.117 710 HG3 LYS 139 HG1 LYS 139 11.209 -1.698 7.314 711 HD2 LYS 139 HD2 LYS 139 12.245 -3.089 9.169 712 HD3 LYS 139 HD1 LYS 139 12.554 -1.565 10.002 713 HE2 LYS 139 HE2 LYS 139 9.889 -2.711 9.200 714 HE3 LYS 139 HE1 LYS 139 10.505 -2.470 10.832 715 HZ1 LYS 139 HZ1 LYS 139 9.911 -0.295 8.900 716 HZ2 LYS 139 HZ2 LYS 139 10.420 -0.092 10.501 717 HZ3 LYS 139 HZ3 LYS 139 8.907 -0.767 10.170 718 H ARG 140 HN ARG 140 15.261 0.850 6.434 719 HA ARG 140 HA ARG 140 14.909 2.894 8.483 720 HB2 ARG 140 HB2 ARG 140 15.940 4.368 6.600 721 HB3 ARG 140 HB1 ARG 140 16.959 3.242 7.480 722 HG2 ARG 140 HG2 ARG 140 17.566 3.058 5.210 723 HG3 ARG 140 HG1 ARG 140 16.626 1.619 5.586 724 HD2 ARG 140 HD2 ARG 140 14.639 2.693 4.591 725 HD3 ARG 140 HD1 ARG 140 15.634 4.085 4.165 726 HE ARG 140 HE ARG 140 16.679 1.612 3.151 727 HH11 ARG 140 HH11 ARG 140 14.371 4.167 2.559 728 HH12 ARG 140 HH12 ARG 140 14.328 3.908 0.848 729 HH21 ARG 140 HH21 ARG 140 16.618 1.259 0.886 730 HH22 ARG 140 HH22 ARG 140 15.609 2.268 -0.106 731 HA PRO 141 HA PRO 141 11.135 4.430 6.890 732 HB2 PRO 141 HB2 PRO 141 11.820 6.974 8.166 733 HB3 PRO 141 HB1 PRO 141 10.625 5.772 8.659 734 HG2 PRO 141 HG2 PRO 141 12.867 6.177 10.092 735 HG3 PRO 141 HG1 PRO 141 12.129 4.585 9.943 736 HD2 PRO 141 HD2 PRO 141 14.396 5.789 8.408 737 HD3 PRO 141 HD1 PRO 141 14.305 4.239 9.245 738 H THR 142 HN THR 142 10.641 5.299 4.983 739 HA THR 142 HA THR 142 12.765 6.739 3.611 740 HB THR 142 HB THR 142 10.284 5.637 2.306 741 HG1 THR 142 HG1 THR 142 11.207 3.650 2.219 742 HG21 THR 142 HG21 THR 142 11.766 5.398 0.362 743 HG22 THR 142 HG22 THR 142 13.111 6.034 1.307 744 HG23 THR 142 HG23 THR 142 11.731 7.067 0.933 745 H LEU 143 HN LEU 143 10.663 7.852 5.536 746 HA LEU 143 HA LEU 143 9.881 10.158 4.128 747 HB2 LEU 143 HB2 LEU 143 8.602 8.436 2.963 748 HB3 LEU 143 HB1 LEU 143 7.823 8.029 4.469 749 HG LEU 143 HG LEU 143 6.770 10.224 4.553 750 HD11 LEU 143 HD11 LEU 143 8.622 11.374 3.282 751 HD12 LEU 143 HD12 LEU 143 6.982 11.833 2.843 752 HD13 LEU 143 HD13 LEU 143 7.892 10.728 1.813 753 HD21 LEU 143 HD21 LEU 143 6.410 8.781 1.935 754 HD22 LEU 143 HD22 LEU 143 5.254 9.901 2.662 755 HD23 LEU 143 HD23 LEU 143 5.626 8.375 3.466 756 H ARG 144 HN ARG 144 7.928 11.229 5.353 757 HA ARG 144 HA ARG 144 8.796 11.529 8.052 758 HB2 ARG 144 HB2 ARG 144 6.404 12.751 6.676 759 HB3 ARG 144 HB1 ARG 144 7.113 13.286 8.194 760 HG2 ARG 144 HG2 ARG 144 9.262 13.643 6.849 761 HG3 ARG 144 HG1 ARG 144 8.236 13.495 5.423 762 HD2 ARG 144 HD2 ARG 144 8.013 15.538 7.628 763 HD3 ARG 144 HD1 ARG 144 8.494 15.819 5.956 764 HE ARG 144 HE ARG 144 5.913 14.662 6.027 765 HH11 ARG 144 HH11 ARG 144 7.580 17.674 6.682 766 HH12 ARG 144 HH12 ARG 144 6.186 18.664 6.387 767 HH21 ARG 144 HH21 ARG 144 4.056 15.959 5.666 768 HH22 ARG 144 HH22 ARG 144 4.179 17.693 5.823 769 H ARG 145 HN ARG 145 6.869 11.885 9.688 770 HA ARG 145 HA ARG 145 6.535 9.394 10.713 771 HB2 ARG 145 HB2 ARG 145 5.403 10.310 12.506 772 HB3 ARG 145 HB1 ARG 145 6.397 11.627 11.902 773 HG2 ARG 145 HG2 ARG 145 3.489 11.214 11.303 774 HG3 ARG 145 HG1 ARG 145 4.139 12.351 12.480 775 HD2 ARG 145 HD2 ARG 145 5.251 13.572 10.736 776 HD3 ARG 145 HD1 ARG 145 4.752 12.373 9.541 777 HE ARG 145 HE ARG 145 2.421 13.288 10.695 778 HH11 ARG 145 HH11 ARG 145 5.060 14.766 8.918 779 HH12 ARG 145 HH12 ARG 145 4.062 16.009 8.236 780 HH21 ARG 145 HH21 ARG 145 1.119 14.935 9.806 781 HH22 ARG 145 HH22 ARG 145 1.836 16.111 8.747 782 H VAL 146 HN VAL 146 4.539 10.657 8.310 783 HA VAL 146 HA VAL 146 2.215 9.143 9.026 784 HB VAL 146 HB VAL 146 1.462 9.742 6.684 785 HG11 VAL 146 HG11 VAL 146 0.856 11.017 8.666 786 HG12 VAL 146 HG12 VAL 146 1.023 12.039 7.232 787 HG13 VAL 146 HG13 VAL 146 2.308 12.002 8.459 788 HG21 VAL 146 HG21 VAL 146 3.689 10.049 5.682 789 HG22 VAL 146 HG22 VAL 146 3.928 11.462 6.710 790 HG23 VAL 146 HG23 VAL 146 2.657 11.465 5.492 791 H ARG 147 HN ARG 147 2.764 6.979 9.203 792 HA ARG 147 HA ARG 147 3.641 5.709 6.699 793 HB2 ARG 147 HB2 ARG 147 5.242 5.882 8.859 794 HB3 ARG 147 HB1 ARG 147 4.380 4.399 9.250 795 HG2 ARG 147 HG2 ARG 147 5.806 4.872 6.643 796 HG3 ARG 147 HG1 ARG 147 6.523 4.064 8.035 797 HD2 ARG 147 HD2 ARG 147 3.977 3.162 6.714 798 HD3 ARG 147 HD1 ARG 147 5.561 2.548 6.275 799 HE ARG 147 HE ARG 147 4.188 2.143 8.841 800 HH11 ARG 147 HH11 ARG 147 6.809 1.377 6.650 801 HH12 ARG 147 HH12 ARG 147 7.285 -0.061 7.504 802 HH21 ARG 147 HH21 ARG 147 4.812 0.253 9.980 803 HH22 ARG 147 HH22 ARG 147 6.148 -0.697 9.397 804 H ILE 148 HN ILE 148 2.565 3.938 6.089 805 HA ILE 148 HA ILE 148 0.143 3.287 7.569 806 HB ILE 148 HB ILE 148 0.980 3.267 4.759 807 HG12 ILE 148 HG12 ILE 148 -1.682 3.634 6.138 808 HG13 ILE 148 HG11 ILE 148 -0.553 4.912 5.728 809 HG21 ILE 148 HG21 ILE 148 0.634 0.954 4.772 810 HG22 ILE 148 HG22 ILE 148 -0.872 1.644 4.165 811 HG23 ILE 148 HG23 ILE 148 -0.767 1.082 5.833 812 HD11 ILE 148 HD11 ILE 148 -0.804 4.082 3.326 813 HD12 ILE 148 HD12 ILE 148 -2.102 5.024 4.057 814 HD13 ILE 148 HD13 ILE 148 -2.243 3.270 3.934 815 H SER 149 HN SER 149 -0.060 1.461 8.707 816 HA SER 149 HA SER 149 1.772 -0.766 8.299 817 HB2 SER 149 HB2 SER 149 -0.554 -0.543 10.214 818 HB3 SER 149 HB1 SER 149 0.712 -1.761 10.241 819 HG SER 149 HG SER 149 2.113 -0.339 11.025 820 H ALA 150 HN ALA 150 1.003 -2.904 7.791 821 HA ALA 150 HA ALA 150 -0.557 -2.911 5.497 822 HB1 ALA 150 HB1 ALA 150 1.105 -4.627 6.074 823 HB2 ALA 150 HB2 ALA 150 -0.442 -5.319 5.587 824 HB3 ALA 150 HB3 ALA 150 0.001 -5.262 7.293 825 H ASP 151 HN ASP 151 -1.464 -4.403 8.594 826 HA ASP 151 HA ASP 151 -4.144 -4.872 7.757 827 HB2 ASP 151 HB2 ASP 151 -3.018 -4.840 10.558 828 HB3 ASP 151 HB1 ASP 151 -4.531 -5.578 10.047 829 H ALA 152 HN ALA 152 -2.633 -2.436 9.860 830 HA ALA 152 HA ALA 152 -4.994 -1.284 10.804 831 HB1 ALA 152 HB1 ALA 152 -3.702 0.592 11.459 832 HB2 ALA 152 HB2 ALA 152 -2.442 0.213 10.288 833 HB3 ALA 152 HB3 ALA 152 -2.701 -0.841 11.676 834 H MET 153 HN MET 153 -3.022 -0.365 7.962 835 HA MET 153 HA MET 153 -4.784 1.600 6.988 836 HB2 MET 153 HB2 MET 153 -2.696 1.531 5.918 837 HB3 MET 153 HB1 MET 153 -2.826 -0.196 5.596 838 HG2 MET 153 HG2 MET 153 -4.949 1.455 4.411 839 HG3 MET 153 HG1 MET 153 -3.327 1.728 3.773 840 HE1 MET 153 HE1 MET 153 -2.366 -1.481 2.038 841 HE2 MET 153 HE2 MET 153 -1.816 -0.912 3.619 842 HE3 MET 153 HE3 MET 153 -2.087 0.241 2.311 843 H MET 154 HN MET 154 -4.407 -1.810 6.148 844 HA MET 154 HA MET 154 -6.351 -2.110 4.246 845 HB2 MET 154 HB2 MET 154 -4.924 -3.848 6.089 846 HB3 MET 154 HB1 MET 154 -6.506 -4.471 5.705 847 HG2 MET 154 HG2 MET 154 -5.976 -4.384 3.331 848 HG3 MET 154 HG1 MET 154 -4.397 -3.692 3.708 849 HE1 MET 154 HE1 MET 154 -5.693 -8.006 4.692 850 HE2 MET 154 HE2 MET 154 -6.666 -6.852 3.778 851 HE3 MET 154 HE3 MET 154 -6.397 -6.609 5.504 852 H GLN 155 HN GLN 155 -6.728 -2.271 7.745 853 HA GLN 155 HA GLN 155 -9.377 -3.180 7.687 854 HB2 GLN 155 HB2 GLN 155 -7.608 -2.058 9.804 855 HB3 GLN 155 HB1 GLN 155 -9.333 -2.300 10.126 856 HG2 GLN 155 HG2 GLN 155 -9.172 -4.616 9.547 857 HG3 GLN 155 HG1 GLN 155 -7.490 -4.412 9.074 858 HE21 GLN 155 HE21 GLN 155 -9.743 -4.548 11.698 859 HE22 GLN 155 HE22 GLN 155 -8.592 -4.786 12.968 860 H ALA 156 HN ALA 156 -7.964 0.023 7.720 861 HA ALA 156 HA ALA 156 -10.239 1.545 8.315 862 HB1 ALA 156 HB1 ALA 156 -9.199 3.349 7.056 863 HB2 ALA 156 HB2 ALA 156 -8.050 2.204 6.367 864 HB3 ALA 156 HB3 ALA 156 -8.034 2.533 8.097 865 H LEU 157 HN LEU 157 -9.085 0.146 5.284 866 HA LEU 157 HA LEU 157 -11.401 0.920 3.793 867 HB2 LEU 157 HB2 LEU 157 -9.461 -1.225 3.164 868 HB3 LEU 157 HB1 LEU 157 -10.625 -0.600 2.090 869 HG LEU 157 HG LEU 157 -8.825 0.444 1.273 870 HD11 LEU 157 HD11 LEU 157 -8.623 2.664 1.952 871 HD12 LEU 157 HD12 LEU 157 -9.338 2.322 3.524 872 HD13 LEU 157 HD13 LEU 157 -10.320 2.202 2.056 873 HD21 LEU 157 HD21 LEU 157 -7.311 -0.589 2.939 874 HD22 LEU 157 HD22 LEU 157 -7.578 0.834 3.947 875 HD23 LEU 157 HD23 LEU 157 -6.847 1.009 2.340 876 H LEU 158 HN LEU 158 -10.492 -1.749 5.787 877 HA LEU 158 HA LEU 158 -11.843 -3.706 4.177 878 HB2 LEU 158 HB2 LEU 158 -9.568 -3.761 5.542 879 HB3 LEU 158 HB1 LEU 158 -10.599 -4.415 6.762 880 HG LEU 158 HG LEU 158 -11.289 -6.130 5.099 881 HD11 LEU 158 HD11 LEU 158 -9.064 -4.839 3.650 882 HD12 LEU 158 HD12 LEU 158 -10.742 -5.017 3.135 883 HD13 LEU 158 HD13 LEU 158 -9.701 -6.437 3.254 884 HD21 LEU 158 HD21 LEU 158 -9.663 -6.698 6.811 885 HD22 LEU 158 HD22 LEU 158 -8.372 -6.025 5.813 886 HD23 LEU 158 HD23 LEU 158 -9.250 -7.459 5.278 887 H GLY 159 HN GLY 159 -13.363 -1.734 6.102 888 HA2 GLY 159 HA2 GLY 159 -14.695 -3.282 8.007 889 HA3 GLY 159 HA1 GLY 159 -15.414 -1.931 7.147 890 H ALA 160 HN ALA 160 -14.717 -3.547 4.613 891 HA ALA 160 HA ALA 160 -17.176 -4.739 4.078 892 HB1 ALA 160 HB1 ALA 160 -15.594 -3.986 2.370 893 HB2 ALA 160 HB2 ALA 160 -16.079 -5.662 2.113 894 HB3 ALA 160 HB3 ALA 160 -14.503 -5.297 2.812 895 H ARG 161 HN ARG 161 -14.105 -6.257 5.166 896 HA ARG 161 HA ARG 161 -15.659 -8.630 5.868 897 HB2 ARG 161 HB2 ARG 161 -14.218 -10.156 4.729 898 HB3 ARG 161 HB1 ARG 161 -14.745 -8.962 3.555 899 HG2 ARG 161 HG2 ARG 161 -12.626 -7.798 3.750 900 HG3 ARG 161 HG1 ARG 161 -12.092 -8.955 4.974 901 HD2 ARG 161 HD2 ARG 161 -11.146 -9.871 3.099 902 HD3 ARG 161 HD1 ARG 161 -12.702 -10.697 3.130 903 HE ARG 161 HE ARG 161 -13.112 -8.457 1.599 904 HH11 ARG 161 HH11 ARG 161 -10.993 -11.241 1.496 905 HH12 ARG 161 HH12 ARG 161 -10.874 -11.244 -0.236 906 HH21 ARG 161 HH21 ARG 161 -12.953 -8.458 -0.684 907 HH22 ARG 161 HH22 ARG 161 -11.992 -9.670 -1.475 908 H ALA 162 HN ALA 162 -13.705 -6.397 7.063 909 HA ALA 162 HA ALA 162 -11.588 -8.001 8.164 910 HB1 ALA 162 HB1 ALA 162 -12.446 -5.164 8.658 911 HB2 ALA 162 HB2 ALA 162 -11.017 -5.767 7.819 912 HB3 ALA 162 HB3 ALA 162 -11.140 -5.931 9.569 913 H LYS 163 HN LYS 163 -14.118 -9.091 8.874 914 HA LYS 163 HA LYS 163 -15.315 -9.881 10.624 915 HB2 LYS 163 HB2 LYS 163 -13.114 -10.176 11.717 916 HB3 LYS 163 HB1 LYS 163 -13.279 -8.567 12.364 917 HG2 LYS 163 HG2 LYS 163 -15.377 -10.588 12.955 918 HG3 LYS 163 HG1 LYS 163 -13.849 -10.637 13.829 919 HD2 LYS 163 HD2 LYS 163 -15.773 -8.308 13.716 920 HD3 LYS 163 HD1 LYS 163 -15.519 -9.391 15.087 921 HE2 LYS 163 HE2 LYS 163 -13.121 -8.648 15.104 922 HE3 LYS 163 HE1 LYS 163 -13.559 -7.433 13.905 923 HZ1 LYS 163 HZ1 LYS 163 -15.120 -6.481 15.470 924 HZ2 LYS 163 HZ2 LYS 163 -13.573 -6.532 16.151 925 HZ3 LYS 163 HZ3 LYS 163 -14.739 -7.663 16.619 926 H GLY 164 HN GLY 164 -14.122 -6.674 11.624 927 HA2 GLY 164 HA2 GLY 164 -16.920 -5.763 11.717 928 HA3 GLY 164 HA1 GLY 164 -15.883 -5.508 13.114 929 H HIS 165 HN HIS 165 -13.708 -4.427 12.508 930 HA HIS 165 HA HIS 165 -14.157 -2.371 10.451 931 HB2 HIS 165 HB2 HIS 165 -13.258 -1.859 13.292 932 HB3 HIS 165 HB1 HIS 165 -13.235 -0.657 12.009 933 HD1 HIS 165 HD1 HIS 165 -15.429 -2.193 14.532 934 HD2 HIS 165 HD2 HIS 165 -15.855 0.138 11.114 935 HE1 HIS 165 HE1 HIS 165 -17.764 -1.273 14.626 936 HE2 HIS 165 HE2 HIS 165 -18.025 0.077 12.517 937 HAB 9XG 201 HAB DRG 201 5.102 4.219 4.560 938 HAC 9XG 201 HAC DRG 201 5.531 5.672 3.618 939 HAA 9XG 201 HAA DRG 201 6.773 4.450 3.986 940 HAD 9XG 201 HAD DRG 201 -1.115 3.540 -2.298 941 HAE 9XG 201 HAE DRG 201 1.270 3.704 -2.965 942 HAF 9XG 201 HAF DRG 201 -1.701 2.866 0.015 943 HAG 9XG 201 HAG DRG 201 6.856 2.969 -0.344 944 HAH 9XG 201 HAH DRG 201 7.383 4.200 1.742 945 HAI 9XG 201 HAI DRG 201 3.043 2.925 -1.425 946 HAJ 9XG 201 HAJ DRG 201 0.084 2.251 1.615 947 HAK 9XG 201 HAK DRG 201 4.595 2.014 -0.688 948 HAL 9XG 201 HAL DRG 201 3.379 3.523 3.144 949 HAM 9XG 201 HAM DRG 201 2.415 1.417 1.645 Start of MODEL 3 1 H1 MET 1 HT1 MET 1 9.704 -0.068 -6.511 2 H2 MET 1 HT2 MET 1 10.678 -1.119 -7.411 3 H3 MET 1 HT3 MET 1 10.972 -0.902 -5.764 4 HA MET 1 HA MET 1 8.856 -1.901 -5.218 5 HB2 MET 1 HB2 MET 1 7.764 -1.227 -7.375 6 HB3 MET 1 HB1 MET 1 8.656 -2.515 -8.169 7 HG2 MET 1 HG2 MET 1 6.627 -3.486 -7.779 8 HG3 MET 1 HG1 MET 1 7.558 -4.041 -6.402 9 HE1 MET 1 HE1 MET 1 7.262 -1.598 -4.061 10 HE2 MET 1 HE2 MET 1 7.281 -3.363 -4.073 11 HE3 MET 1 HE3 MET 1 5.900 -2.501 -3.385 12 H ASP 2 HN ASP 2 9.854 -3.449 -4.120 13 HA ASP 2 HA ASP 2 12.017 -4.969 -4.952 14 HB2 ASP 2 HB2 ASP 2 9.883 -5.629 -2.920 15 HB3 ASP 2 HB1 ASP 2 11.349 -6.594 -3.145 16 H ASP 3 HN ASP 3 12.217 -6.447 -6.412 17 HA ASP 3 HA ASP 3 10.007 -7.707 -7.599 18 HB2 ASP 3 HB2 ASP 3 11.763 -9.158 -8.681 19 HB3 ASP 3 HB1 ASP 3 11.859 -7.430 -8.978 20 H ILE 4 HN ILE 4 11.835 -8.396 -4.784 21 HA ILE 4 HA ILE 4 11.301 -11.154 -4.659 22 HB ILE 4 HB ILE 4 12.970 -10.333 -3.186 23 HG12 ILE 4 HG12 ILE 4 11.373 -12.185 -2.355 24 HG13 ILE 4 HG11 ILE 4 12.499 -11.455 -1.227 25 HG21 ILE 4 HG21 ILE 4 12.394 -8.117 -2.865 26 HG22 ILE 4 HG22 ILE 4 12.372 -8.847 -1.262 27 HG23 ILE 4 HG23 ILE 4 10.857 -8.530 -2.112 28 HD11 ILE 4 HD11 ILE 4 10.325 -11.799 -0.208 29 HD12 ILE 4 HD12 ILE 4 9.575 -10.813 -1.465 30 HD13 ILE 4 HD13 ILE 4 10.701 -10.078 -0.329 31 H TYR 5 HN TYR 5 9.563 -8.332 -3.524 32 HA TYR 5 HA TYR 5 7.365 -9.928 -2.605 33 HB2 TYR 5 HB2 TYR 5 7.757 -6.956 -2.821 34 HB3 TYR 5 HB1 TYR 5 6.318 -7.702 -2.160 35 HD1 TYR 5 HD1 TYR 5 6.926 -9.627 -0.369 36 HD2 TYR 5 HD2 TYR 5 9.285 -6.212 -1.236 37 HE1 TYR 5 HE1 TYR 5 7.979 -9.814 1.817 38 HE2 TYR 5 HE2 TYR 5 10.348 -6.376 0.948 39 HH TYR 5 HH TYR 5 9.970 -7.352 3.148 40 H LYS 6 HN LYS 6 8.246 -8.160 -5.486 41 HA LYS 6 HA LYS 6 5.806 -8.260 -6.820 42 HB2 LYS 6 HB2 LYS 6 8.588 -8.505 -7.920 43 HB3 LYS 6 HB1 LYS 6 7.146 -8.380 -8.909 44 HG2 LYS 6 HG2 LYS 6 6.636 -6.215 -7.962 45 HG3 LYS 6 HG1 LYS 6 8.034 -6.338 -6.901 46 HD2 LYS 6 HD2 LYS 6 8.601 -4.920 -8.756 47 HD3 LYS 6 HD1 LYS 6 9.490 -6.430 -8.922 48 HE2 LYS 6 HE2 LYS 6 8.630 -5.759 -11.069 49 HE3 LYS 6 HE1 LYS 6 7.785 -7.212 -10.539 50 HZ1 LYS 6 HZ1 LYS 6 6.777 -4.418 -10.523 51 HZ2 LYS 6 HZ2 LYS 6 5.990 -5.693 -9.731 52 HZ3 LYS 6 HZ3 LYS 6 6.180 -5.734 -11.403 53 H ALA 7 HN ALA 7 8.182 -10.763 -6.253 54 HA ALA 7 HA ALA 7 6.640 -12.862 -7.536 55 HB1 ALA 7 HB1 ALA 7 8.208 -14.292 -6.133 56 HB2 ALA 7 HB2 ALA 7 9.015 -12.773 -5.698 57 HB3 ALA 7 HB3 ALA 7 8.929 -13.286 -7.392 58 H ALA 8 HN ALA 8 6.721 -11.394 -4.345 59 HA ALA 8 HA ALA 8 5.762 -13.705 -3.039 60 HB1 ALA 8 HB1 ALA 8 5.617 -12.553 -1.092 61 HB2 ALA 8 HB2 ALA 8 5.476 -10.994 -1.922 62 HB3 ALA 8 HB3 ALA 8 7.008 -11.871 -1.943 63 H VAL 9 HN VAL 9 4.192 -10.974 -4.555 64 HA VAL 9 HA VAL 9 1.558 -11.664 -3.675 65 HB VAL 9 HB VAL 9 1.726 -9.482 -4.536 66 HG11 VAL 9 HG11 VAL 9 2.632 -8.966 -6.779 67 HG12 VAL 9 HG12 VAL 9 3.092 -10.661 -6.948 68 HG13 VAL 9 HG13 VAL 9 3.827 -9.668 -5.690 69 HG21 VAL 9 HG21 VAL 9 0.240 -9.398 -6.446 70 HG22 VAL 9 HG22 VAL 9 -0.279 -10.668 -5.332 71 HG23 VAL 9 HG23 VAL 9 0.574 -11.090 -6.813 72 H GLU 10 HN GLU 10 3.690 -12.760 -6.170 73 HA GLU 10 HA GLU 10 1.834 -14.380 -7.567 74 HB2 GLU 10 HB2 GLU 10 4.757 -14.957 -7.401 75 HB3 GLU 10 HB1 GLU 10 3.675 -15.103 -8.793 76 HG2 GLU 10 HG2 GLU 10 3.491 -12.532 -8.469 77 HG3 GLU 10 HG1 GLU 10 4.924 -12.743 -7.588 78 H GLN 11 HN GLN 11 3.609 -14.483 -4.744 79 HA GLN 11 HA GLN 11 3.475 -17.296 -4.179 80 HB2 GLN 11 HB2 GLN 11 5.428 -16.500 -3.330 81 HB3 GLN 11 HB1 GLN 11 4.763 -14.920 -3.140 82 HG2 GLN 11 HG2 GLN 11 3.564 -15.671 -1.165 83 HG3 GLN 11 HG1 GLN 11 4.314 -17.220 -1.362 84 HE21 GLN 11 HE21 GLN 11 6.508 -17.499 -1.047 85 HE22 GLN 11 HE22 GLN 11 7.431 -16.373 -0.119 86 H LEU 12 HN LEU 12 1.703 -14.387 -3.384 87 HA LEU 12 HA LEU 12 0.349 -15.342 -1.126 88 HB2 LEU 12 HB2 LEU 12 -0.710 -13.312 -3.070 89 HB3 LEU 12 HB1 LEU 12 -1.226 -13.581 -1.472 90 HG LEU 12 HG LEU 12 1.554 -12.690 -2.016 91 HD11 LEU 12 HD11 LEU 12 -0.819 -10.937 -1.362 92 HD12 LEU 12 HD12 LEU 12 -0.137 -11.105 -2.973 93 HD13 LEU 12 HD13 LEU 12 0.834 -10.423 -1.670 94 HD21 LEU 12 HD21 LEU 12 1.182 -13.686 0.140 95 HD22 LEU 12 HD22 LEU 12 -0.259 -12.720 0.397 96 HD23 LEU 12 HD23 LEU 12 1.327 -11.942 0.348 97 H THR 13 HN THR 13 -1.804 -16.052 -0.924 98 HA THR 13 HA THR 13 -2.581 -17.904 -2.998 99 HB THR 13 HB THR 13 -4.298 -18.629 -1.430 100 HG1 THR 13 HG1 THR 13 -4.233 -17.526 0.726 101 HG21 THR 13 HG21 THR 13 -2.873 -19.339 0.451 102 HG22 THR 13 HG22 THR 13 -1.658 -18.164 -0.046 103 HG23 THR 13 HG23 THR 13 -2.045 -19.525 -1.093 104 H GLU 14 HN GLU 14 -5.063 -17.992 -3.428 105 HA GLU 14 HA GLU 14 -5.931 -15.728 -4.759 106 HB2 GLU 14 HB2 GLU 14 -7.222 -17.482 -5.394 107 HB3 GLU 14 HB1 GLU 14 -7.189 -18.221 -3.799 108 HG2 GLU 14 HG2 GLU 14 -8.850 -16.723 -3.018 109 HG3 GLU 14 HG1 GLU 14 -8.789 -15.818 -4.511 110 H GLU 15 HN GLU 15 -6.983 -16.889 -1.596 111 HA GLU 15 HA GLU 15 -8.578 -14.757 -0.831 112 HB2 GLU 15 HB2 GLU 15 -6.841 -16.429 0.998 113 HB3 GLU 15 HB1 GLU 15 -8.279 -15.527 1.457 114 HG2 GLU 15 HG2 GLU 15 -9.692 -16.981 0.235 115 HG3 GLU 15 HG1 GLU 15 -8.316 -17.765 -0.542 116 H GLN 16 HN GLN 16 -5.084 -15.106 -0.654 117 HA GLN 16 HA GLN 16 -4.524 -12.935 0.990 118 HB2 GLN 16 HB2 GLN 16 -2.939 -14.349 -1.093 119 HB3 GLN 16 HB1 GLN 16 -2.284 -13.047 -0.148 120 HG2 GLN 16 HG2 GLN 16 -3.263 -15.676 0.752 121 HG3 GLN 16 HG1 GLN 16 -1.661 -15.011 0.946 122 HE21 GLN 16 HE21 GLN 16 -1.499 -13.136 2.348 123 HE22 GLN 16 HE22 GLN 16 -2.559 -13.006 3.705 124 H LYS 17 HN LYS 17 -4.487 -13.113 -2.520 125 HA LYS 17 HA LYS 17 -3.953 -10.345 -2.825 126 HB2 LYS 17 HB2 LYS 17 -5.031 -12.305 -4.866 127 HB3 LYS 17 HB1 LYS 17 -4.177 -10.803 -5.186 128 HG2 LYS 17 HG2 LYS 17 -2.136 -11.675 -4.333 129 HG3 LYS 17 HG1 LYS 17 -2.953 -13.090 -3.679 130 HD2 LYS 17 HD2 LYS 17 -1.658 -13.527 -5.761 131 HD3 LYS 17 HD1 LYS 17 -3.376 -13.948 -5.874 132 HE2 LYS 17 HE2 LYS 17 -3.845 -12.193 -7.279 133 HE3 LYS 17 HE1 LYS 17 -2.465 -11.242 -6.745 134 HZ1 LYS 17 HZ1 LYS 17 -1.065 -13.028 -7.831 135 HZ2 LYS 17 HZ2 LYS 17 -1.909 -12.004 -8.867 136 HZ3 LYS 17 HZ3 LYS 17 -2.484 -13.567 -8.575 137 H ASN 18 HN ASN 18 -6.803 -12.280 -2.541 138 HA ASN 18 HA ASN 18 -8.676 -10.551 -3.774 139 HB2 ASN 18 HB2 ASN 18 -9.023 -13.002 -3.206 140 HB3 ASN 18 HB1 ASN 18 -9.193 -12.520 -1.523 141 HD21 ASN 18 HD21 ASN 18 -11.285 -13.369 -1.497 142 HD22 ASN 18 HD22 ASN 18 -12.609 -12.536 -2.237 143 H GLU 19 HN GLU 19 -7.718 -11.046 -0.399 144 HA GLU 19 HA GLU 19 -9.300 -9.096 0.814 145 HB2 GLU 19 HB2 GLU 19 -7.792 -10.871 1.879 146 HB3 GLU 19 HB1 GLU 19 -6.512 -9.718 1.635 147 HG2 GLU 19 HG2 GLU 19 -7.360 -8.197 3.150 148 HG3 GLU 19 HG1 GLU 19 -8.960 -8.937 3.121 149 H PHE 20 HN PHE 20 -5.964 -8.948 -0.237 150 HA PHE 20 HA PHE 20 -5.526 -6.275 0.437 151 HB2 PHE 20 HB2 PHE 20 -4.012 -7.959 -1.566 152 HB3 PHE 20 HB1 PHE 20 -3.424 -6.535 -0.739 153 HD1 PHE 20 HD1 PHE 20 -5.049 -7.625 1.872 154 HD2 PHE 20 HD2 PHE 20 -1.960 -9.083 -0.664 155 HE1 PHE 20 HE1 PHE 20 -4.267 -9.078 3.678 156 HE2 PHE 20 HE2 PHE 20 -1.164 -10.539 1.148 157 HZ PHE 20 HZ PHE 20 -2.326 -10.552 3.315 158 H LYS 21 HN LYS 21 -6.733 -7.705 -2.536 159 HA LYS 21 HA LYS 21 -6.669 -5.489 -4.225 160 HB2 LYS 21 HB2 LYS 21 -7.523 -7.716 -4.820 161 HB3 LYS 21 HB1 LYS 21 -8.940 -7.366 -3.907 162 HG2 LYS 21 HG2 LYS 21 -8.195 -5.448 -6.029 163 HG3 LYS 21 HG1 LYS 21 -8.866 -7.007 -6.514 164 HD2 LYS 21 HD2 LYS 21 -10.900 -6.562 -5.616 165 HD3 LYS 21 HD1 LYS 21 -10.255 -5.536 -4.346 166 HE2 LYS 21 HE2 LYS 21 -11.575 -4.268 -5.967 167 HE3 LYS 21 HE1 LYS 21 -9.892 -3.754 -5.929 168 HZ1 LYS 21 HZ1 LYS 21 -9.497 -5.091 -7.916 169 HZ2 LYS 21 HZ2 LYS 21 -10.681 -3.926 -8.193 170 HZ3 LYS 21 HZ3 LYS 21 -11.123 -5.543 -7.962 171 H ALA 22 HN ALA 22 -8.982 -6.447 -1.811 172 HA ALA 22 HA ALA 22 -10.905 -4.592 -2.404 173 HB1 ALA 22 HB1 ALA 22 -10.279 -5.754 0.302 174 HB2 ALA 22 HB2 ALA 22 -11.289 -6.499 -0.939 175 HB3 ALA 22 HB3 ALA 22 -11.803 -4.996 -0.170 176 H ALA 23 HN ALA 23 -8.198 -4.373 -0.130 177 HA ALA 23 HA ALA 23 -8.808 -1.853 0.932 178 HB1 ALA 23 HB1 ALA 23 -7.147 -3.338 1.936 179 HB2 ALA 23 HB2 ALA 23 -6.444 -1.756 1.590 180 HB3 ALA 23 HB3 ALA 23 -6.094 -3.130 0.538 181 H PHE 24 HN PHE 24 -6.721 -2.747 -1.819 182 HA PHE 24 HA PHE 24 -5.983 -0.319 -2.844 183 HB2 PHE 24 HB2 PHE 24 -5.400 -2.416 -3.907 184 HB3 PHE 24 HB1 PHE 24 -7.058 -2.726 -4.250 185 HD1 PHE 24 HD1 PHE 24 -7.273 -2.848 -6.522 186 HD2 PHE 24 HD2 PHE 24 -5.065 0.376 -4.845 187 HE1 PHE 24 HE1 PHE 24 -7.103 -1.816 -8.744 188 HE2 PHE 24 HE2 PHE 24 -4.897 1.417 -7.057 189 HZ PHE 24 HZ PHE 24 -5.911 0.321 -9.015 190 H ASP 25 HN ASP 25 -8.841 -2.096 -3.602 191 HA ASP 25 HA ASP 25 -10.148 -0.335 -5.294 192 HB2 ASP 25 HB2 ASP 25 -10.740 -2.724 -4.819 193 HB3 ASP 25 HB1 ASP 25 -11.493 -2.177 -3.368 194 H ILE 26 HN ILE 26 -10.405 -0.456 -1.749 195 HA ILE 26 HA ILE 26 -12.488 1.591 -1.703 196 HB ILE 26 HB ILE 26 -10.954 0.423 0.607 197 HG12 ILE 26 HG12 ILE 26 -13.627 -0.576 -0.174 198 HG13 ILE 26 HG11 ILE 26 -12.249 -1.071 -1.100 199 HG21 ILE 26 HG21 ILE 26 -12.925 1.007 1.898 200 HG22 ILE 26 HG22 ILE 26 -13.699 1.628 0.442 201 HG23 ILE 26 HG23 ILE 26 -12.261 2.430 1.088 202 HD11 ILE 26 HD11 ILE 26 -12.538 -1.492 1.844 203 HD12 ILE 26 HD12 ILE 26 -11.232 -2.079 0.808 204 HD13 ILE 26 HD13 ILE 26 -12.868 -2.697 0.599 205 H PHE 27 HN PHE 27 -9.090 1.229 -1.290 206 HA PHE 27 HA PHE 27 -8.343 3.686 -0.236 207 HB2 PHE 27 HB2 PHE 27 -7.143 1.497 -1.661 208 HB3 PHE 27 HB1 PHE 27 -6.583 3.006 -2.346 209 HD1 PHE 27 HD1 PHE 27 -5.581 4.716 -0.852 210 HD2 PHE 27 HD2 PHE 27 -6.254 0.690 0.314 211 HE1 PHE 27 HE1 PHE 27 -3.903 4.951 0.916 212 HE2 PHE 27 HE2 PHE 27 -4.577 0.928 2.087 213 HZ PHE 27 HZ PHE 27 -3.400 3.061 2.386 214 H VAL 28 HN VAL 28 -9.620 2.734 -3.256 215 HA VAL 28 HA VAL 28 -9.067 5.376 -4.390 216 HB VAL 28 HB VAL 28 -9.484 4.350 -6.610 217 HG11 VAL 28 HG11 VAL 28 -7.225 4.669 -5.678 218 HG12 VAL 28 HG12 VAL 28 -7.325 3.305 -6.795 219 HG13 VAL 28 HG13 VAL 28 -7.274 3.019 -5.051 220 HG21 VAL 28 HG21 VAL 28 -9.336 1.699 -5.178 221 HG22 VAL 28 HG22 VAL 28 -9.637 1.991 -6.895 222 HG23 VAL 28 HG23 VAL 28 -10.846 2.446 -5.699 223 H LEU 29 HN LEU 29 -11.270 4.735 -2.546 224 HA LEU 29 HA LEU 29 -13.717 4.408 -3.859 225 HB2 LEU 29 HB2 LEU 29 -13.062 5.943 -1.353 226 HB3 LEU 29 HB1 LEU 29 -14.691 5.814 -1.969 227 HG LEU 29 HG LEU 29 -12.970 3.540 -1.022 228 HD11 LEU 29 HD11 LEU 29 -15.495 4.701 0.140 229 HD12 LEU 29 HD12 LEU 29 -13.869 5.018 0.740 230 HD13 LEU 29 HD13 LEU 29 -14.524 3.383 0.800 231 HD21 LEU 29 HD21 LEU 29 -15.733 3.582 -2.205 232 HD22 LEU 29 HD22 LEU 29 -15.087 2.237 -1.264 233 HD23 LEU 29 HD23 LEU 29 -14.317 2.699 -2.781 234 H GLY 30 HN GLY 30 -14.551 5.545 -5.451 235 HA2 GLY 30 HA2 GLY 30 -15.401 7.377 -6.569 236 HA3 GLY 30 HA1 GLY 30 -14.796 8.403 -5.281 237 H ALA 31 HN ALA 31 -12.400 6.344 -6.527 238 HA ALA 31 HA ALA 31 -10.999 8.577 -7.675 239 HB1 ALA 31 HB1 ALA 31 -9.810 6.788 -6.452 240 HB2 ALA 31 HB2 ALA 31 -9.189 7.027 -8.084 241 HB3 ALA 31 HB3 ALA 31 -10.240 5.659 -7.739 242 H GLU 32 HN GLU 32 -10.700 9.076 -9.719 243 HA GLU 32 HA GLU 32 -12.662 8.287 -11.589 244 HB2 GLU 32 HB2 GLU 32 -11.670 10.533 -11.538 245 HB3 GLU 32 HB1 GLU 32 -10.112 9.858 -11.988 246 HG2 GLU 32 HG2 GLU 32 -11.068 9.118 -14.123 247 HG3 GLU 32 HG1 GLU 32 -12.604 9.859 -13.674 248 H ASP 33 HN ASP 33 -9.214 7.520 -11.250 249 HA ASP 33 HA ASP 33 -9.384 5.769 -13.579 250 HB2 ASP 33 HB2 ASP 33 -7.446 7.332 -13.403 251 HB3 ASP 33 HB1 ASP 33 -6.965 6.476 -11.953 252 H GLY 34 HN GLY 34 -9.429 5.685 -10.184 253 HA2 GLY 34 HA2 GLY 34 -9.819 3.902 -8.771 254 HA3 GLY 34 HA1 GLY 34 -9.784 2.834 -10.164 255 H SER 35 HN SER 35 -7.123 4.851 -10.045 256 HA SER 35 HA SER 35 -5.491 2.781 -8.740 257 HB2 SER 35 HB2 SER 35 -3.562 3.905 -9.886 258 HB3 SER 35 HB1 SER 35 -4.744 3.263 -11.000 259 HG SER 35 HG SER 35 -5.214 5.178 -11.685 260 H ILE 36 HN ILE 36 -4.019 3.518 -7.079 261 HA ILE 36 HA ILE 36 -5.276 5.534 -5.439 262 HB ILE 36 HB ILE 36 -2.830 3.819 -5.062 263 HG12 ILE 36 HG12 ILE 36 -5.266 3.949 -3.323 264 HG13 ILE 36 HG11 ILE 36 -5.199 2.923 -4.762 265 HG21 ILE 36 HG21 ILE 36 -2.480 4.718 -2.864 266 HG22 ILE 36 HG22 ILE 36 -3.858 5.798 -3.039 267 HG23 ILE 36 HG23 ILE 36 -2.420 6.040 -4.031 268 HD11 ILE 36 HD11 ILE 36 -3.583 1.543 -3.846 269 HD12 ILE 36 HD12 ILE 36 -4.639 1.905 -2.480 270 HD13 ILE 36 HD13 ILE 36 -3.096 2.745 -2.652 271 H SER 37 HN SER 37 -4.970 7.572 -6.083 272 HA SER 37 HA SER 37 -2.328 8.478 -6.823 273 HB2 SER 37 HB2 SER 37 -3.377 10.655 -7.086 274 HB3 SER 37 HB1 SER 37 -4.367 9.426 -7.866 275 HG SER 37 HG SER 37 -5.946 10.029 -6.612 276 H THR 38 HN THR 38 -1.858 10.734 -5.535 277 HA THR 38 HA THR 38 -1.069 9.740 -3.022 278 HB THR 38 HB THR 38 -0.357 12.185 -2.647 279 HG1 THR 38 HG1 THR 38 -0.701 12.416 -5.445 280 HG21 THR 38 HG21 THR 38 1.169 10.406 -3.292 281 HG22 THR 38 HG22 THR 38 1.536 11.859 -4.224 282 HG23 THR 38 HG23 THR 38 0.651 10.532 -4.973 283 H LYS 39 HN LYS 39 -3.743 11.927 -3.949 284 HA LYS 39 HA LYS 39 -4.378 12.314 -1.183 285 HB2 LYS 39 HB2 LYS 39 -5.030 13.603 -3.553 286 HB3 LYS 39 HB1 LYS 39 -6.533 13.041 -2.849 287 HG2 LYS 39 HG2 LYS 39 -4.420 14.692 -1.501 288 HG3 LYS 39 HG1 LYS 39 -6.002 15.220 -2.025 289 HD2 LYS 39 HD2 LYS 39 -7.107 13.936 -0.385 290 HD3 LYS 39 HD1 LYS 39 -5.640 13.032 -0.020 291 HE2 LYS 39 HE2 LYS 39 -6.111 14.668 1.719 292 HE3 LYS 39 HE1 LYS 39 -4.604 15.033 0.882 293 HZ1 LYS 39 HZ1 LYS 39 -5.774 16.694 -0.434 294 HZ2 LYS 39 HZ2 LYS 39 -5.925 17.029 1.214 295 HZ3 LYS 39 HZ3 LYS 39 -7.222 16.348 0.371 296 H GLU 40 HN GLU 40 -5.507 10.204 -3.790 297 HA GLU 40 HA GLU 40 -7.569 8.869 -2.436 298 HB2 GLU 40 HB2 GLU 40 -5.546 8.134 -4.500 299 HB3 GLU 40 HB1 GLU 40 -6.309 6.798 -3.659 300 HG2 GLU 40 HG2 GLU 40 -7.331 7.476 -5.841 301 HG3 GLU 40 HG1 GLU 40 -8.438 7.373 -4.483 302 H LEU 41 HN LEU 41 -4.073 8.306 -2.391 303 HA LEU 41 HA LEU 41 -3.931 6.372 -0.370 304 HB2 LEU 41 HB2 LEU 41 -2.094 6.947 -1.905 305 HB3 LEU 41 HB1 LEU 41 -1.964 8.522 -1.191 306 HG LEU 41 HG LEU 41 -1.121 7.578 0.855 307 HD11 LEU 41 HD11 LEU 41 -2.005 5.008 -0.400 308 HD12 LEU 41 HD12 LEU 41 -2.177 5.571 1.260 309 HD13 LEU 41 HD13 LEU 41 -0.625 4.982 0.688 310 HD21 LEU 41 HD21 LEU 41 1.020 6.801 0.023 311 HD22 LEU 41 HD22 LEU 41 0.397 8.015 -1.088 312 HD23 LEU 41 HD23 LEU 41 0.287 6.308 -1.509 313 H GLY 42 HN GLY 42 -3.866 9.914 -0.261 314 HA2 GLY 42 HA2 GLY 42 -3.236 10.255 2.436 315 HA3 GLY 42 HA1 GLY 42 -4.032 11.440 1.428 316 H LYS 43 HN LYS 43 -6.291 9.860 0.777 317 HA LYS 43 HA LYS 43 -8.132 10.455 2.719 318 HB2 LYS 43 HB2 LYS 43 -8.937 9.852 0.582 319 HB3 LYS 43 HB1 LYS 43 -8.060 8.331 0.589 320 HG2 LYS 43 HG2 LYS 43 -9.625 7.795 2.622 321 HG3 LYS 43 HG1 LYS 43 -10.637 9.043 1.892 322 HD2 LYS 43 HD2 LYS 43 -10.606 7.829 -0.236 323 HD3 LYS 43 HD1 LYS 43 -9.592 6.584 0.486 324 HE2 LYS 43 HE2 LYS 43 -11.894 5.839 0.411 325 HE3 LYS 43 HE1 LYS 43 -11.393 6.065 2.083 326 HZ1 LYS 43 HZ1 LYS 43 -13.619 6.945 1.635 327 HZ2 LYS 43 HZ2 LYS 43 -12.970 8.018 0.504 328 HZ3 LYS 43 HZ3 LYS 43 -12.556 8.158 2.133 329 H VAL 44 HN VAL 44 -6.477 7.366 2.259 330 HA VAL 44 HA VAL 44 -7.798 6.080 4.427 331 HB VAL 44 HB VAL 44 -5.307 5.302 2.951 332 HG11 VAL 44 HG11 VAL 44 -5.572 4.128 5.148 333 HG12 VAL 44 HG12 VAL 44 -5.729 3.030 3.775 334 HG13 VAL 44 HG13 VAL 44 -7.171 3.592 4.631 335 HG21 VAL 44 HG21 VAL 44 -6.919 3.951 1.654 336 HG22 VAL 44 HG22 VAL 44 -7.217 5.684 1.527 337 HG23 VAL 44 HG23 VAL 44 -8.228 4.694 2.590 338 H MET 45 HN MET 45 -4.639 7.510 3.968 339 HA MET 45 HA MET 45 -3.519 7.040 6.464 340 HB2 MET 45 HB2 MET 45 -3.403 9.487 4.709 341 HB3 MET 45 HB1 MET 45 -2.323 9.172 6.058 342 HG2 MET 45 HG2 MET 45 -2.573 7.064 4.042 343 HG3 MET 45 HG1 MET 45 -1.749 8.538 3.559 344 HE1 MET 45 HE1 MET 45 -0.249 9.515 6.167 345 HE2 MET 45 HE2 MET 45 0.115 9.475 4.445 346 HE3 MET 45 HE3 MET 45 1.265 8.817 5.598 347 H ARG 46 HN ARG 46 -5.720 9.721 5.467 348 HA ARG 46 HA ARG 46 -5.925 10.801 8.076 349 HB2 ARG 46 HB2 ARG 46 -7.278 11.196 5.493 350 HB3 ARG 46 HB1 ARG 46 -8.170 11.676 6.917 351 HG2 ARG 46 HG2 ARG 46 -7.019 13.628 6.477 352 HG3 ARG 46 HG1 ARG 46 -5.909 12.830 7.555 353 HD2 ARG 46 HD2 ARG 46 -4.460 12.348 5.946 354 HD3 ARG 46 HD1 ARG 46 -5.638 12.235 4.673 355 HE ARG 46 HE ARG 46 -4.152 14.554 5.431 356 HH11 ARG 46 HH11 ARG 46 -7.242 13.527 4.112 357 HH12 ARG 46 HH12 ARG 46 -7.582 15.069 3.395 358 HH21 ARG 46 HH21 ARG 46 -4.619 16.580 4.506 359 HH22 ARG 46 HH22 ARG 46 -6.095 16.799 3.621 360 H MET 47 HN MET 47 -7.652 8.299 6.366 361 HA MET 47 HA MET 47 -9.730 7.839 8.158 362 HB2 MET 47 HB2 MET 47 -8.193 6.277 6.150 363 HB3 MET 47 HB1 MET 47 -9.410 5.491 7.063 364 HG2 MET 47 HG2 MET 47 -11.103 6.969 6.202 365 HG3 MET 47 HG1 MET 47 -9.863 7.895 5.365 366 HE1 MET 47 HE1 MET 47 -10.384 4.005 5.777 367 HE2 MET 47 HE2 MET 47 -11.128 3.596 4.232 368 HE3 MET 47 HE3 MET 47 -11.999 4.592 5.397 369 H LEU 48 HN LEU 48 -6.349 7.397 8.409 370 HA LEU 48 HA LEU 48 -6.560 5.496 10.630 371 HB2 LEU 48 HB2 LEU 48 -4.119 6.464 9.217 372 HB3 LEU 48 HB1 LEU 48 -4.185 5.159 10.361 373 HG LEU 48 HG LEU 48 -5.343 5.205 7.594 374 HD11 LEU 48 HD11 LEU 48 -3.725 3.554 7.071 375 HD12 LEU 48 HD12 LEU 48 -3.260 3.374 8.763 376 HD13 LEU 48 HD13 LEU 48 -2.875 4.865 7.897 377 HD21 LEU 48 HD21 LEU 48 -6.062 2.898 8.036 378 HD22 LEU 48 HD22 LEU 48 -6.890 4.057 9.070 379 HD23 LEU 48 HD23 LEU 48 -5.575 3.075 9.718 380 H GLY 49 HN GLY 49 -6.504 8.760 10.192 381 HA2 GLY 49 HA2 GLY 49 -6.362 10.313 11.981 382 HA3 GLY 49 HA1 GLY 49 -5.301 9.196 12.830 383 H GLN 50 HN GLN 50 -4.201 9.149 9.775 384 HA GLN 50 HA GLN 50 -2.017 10.945 10.241 385 HB2 GLN 50 HB2 GLN 50 -2.890 9.542 7.724 386 HB3 GLN 50 HB1 GLN 50 -1.346 10.328 7.931 387 HG2 GLN 50 HG2 GLN 50 -2.366 7.915 9.429 388 HG3 GLN 50 HG1 GLN 50 -1.192 7.890 8.115 389 HE21 GLN 50 HE21 GLN 50 0.362 6.894 9.430 390 HE22 GLN 50 HE22 GLN 50 1.198 7.757 10.671 391 H ASN 51 HN ASN 51 -1.525 12.819 8.865 392 HA ASN 51 HA ASN 51 -3.543 13.558 6.927 393 HB2 ASN 51 HB2 ASN 51 -4.424 14.854 8.651 394 HB3 ASN 51 HB1 ASN 51 -2.851 15.353 9.192 395 HD21 ASN 51 HD21 ASN 51 -3.241 17.543 9.035 396 HD22 ASN 51 HD22 ASN 51 -3.448 18.346 7.519 397 HA PRO 52 HA PRO 52 0.851 13.753 5.347 398 HB2 PRO 52 HB2 PRO 52 -0.161 12.869 2.923 399 HB3 PRO 52 HB1 PRO 52 0.659 11.891 4.106 400 HG2 PRO 52 HG2 PRO 52 -2.219 12.181 3.534 401 HG3 PRO 52 HG1 PRO 52 -1.344 10.767 4.131 402 HD2 PRO 52 HD2 PRO 52 -2.881 12.251 5.693 403 HD3 PRO 52 HD1 PRO 52 -1.462 11.478 6.290 404 H THR 53 HN THR 53 1.668 14.992 3.719 405 HA THR 53 HA THR 53 -0.240 16.401 2.013 406 HB THR 53 HB THR 53 1.775 17.705 1.234 407 HG1 THR 53 HG1 THR 53 3.055 16.551 3.504 408 HG21 THR 53 HG21 THR 53 1.184 17.844 4.193 409 HG22 THR 53 HG22 THR 53 0.306 18.682 2.914 410 HG23 THR 53 HG23 THR 53 1.985 19.100 3.253 411 HA PRO 54 HA PRO 54 0.325 13.743 -1.426 412 HB2 PRO 54 HB2 PRO 54 1.138 16.222 -2.837 413 HB3 PRO 54 HB1 PRO 54 0.052 14.944 -3.372 414 HG2 PRO 54 HG2 PRO 54 -0.961 17.134 -2.423 415 HG3 PRO 54 HG1 PRO 54 -1.602 15.597 -1.878 416 HD2 PRO 54 HD2 PRO 54 0.230 17.496 -0.487 417 HD3 PRO 54 HD1 PRO 54 -1.123 16.556 0.175 418 H GLU 55 HN GLU 55 2.891 16.047 -0.742 419 HA GLU 55 HA GLU 55 5.032 15.046 -2.154 420 HB2 GLU 55 HB2 GLU 55 4.856 16.167 0.608 421 HB3 GLU 55 HB1 GLU 55 6.349 15.943 -0.220 422 HG2 GLU 55 HG2 GLU 55 5.666 17.465 -1.873 423 HG3 GLU 55 HG1 GLU 55 4.111 17.610 -1.129 424 H GLU 56 HN GLU 56 4.162 14.282 1.161 425 HA GLU 56 HA GLU 56 5.972 12.251 1.696 426 HB2 GLU 56 HB2 GLU 56 3.146 12.483 2.735 427 HB3 GLU 56 HB1 GLU 56 4.534 11.863 3.570 428 HG2 GLU 56 HG2 GLU 56 5.548 14.135 3.438 429 HG3 GLU 56 HG1 GLU 56 4.030 14.663 2.773 430 H LEU 57 HN LEU 57 2.590 12.025 1.082 431 HA LEU 57 HA LEU 57 2.056 9.415 0.616 432 HB2 LEU 57 HB2 LEU 57 0.997 11.826 -0.808 433 HB3 LEU 57 HB1 LEU 57 0.247 10.240 -0.906 434 HG LEU 57 HG LEU 57 0.736 11.564 1.728 435 HD11 LEU 57 HD11 LEU 57 -0.485 13.223 0.588 436 HD12 LEU 57 HD12 LEU 57 -1.654 12.336 1.568 437 HD13 LEU 57 HD13 LEU 57 -1.545 12.030 -0.170 438 HD21 LEU 57 HD21 LEU 57 -1.265 9.514 0.789 439 HD22 LEU 57 HD22 LEU 57 -1.128 10.146 2.424 440 HD23 LEU 57 HD23 LEU 57 0.178 9.196 1.734 441 H GLN 58 HN GLN 58 3.421 11.640 -1.743 442 HA GLN 58 HA GLN 58 3.198 10.016 -4.002 443 HB2 GLN 58 HB2 GLN 58 3.785 12.417 -4.035 444 HB3 GLN 58 HB1 GLN 58 5.365 12.026 -3.371 445 HG2 GLN 58 HG2 GLN 58 5.920 10.765 -5.356 446 HG3 GLN 58 HG1 GLN 58 4.308 11.049 -6.015 447 HE21 GLN 58 HE21 GLN 58 7.396 12.457 -5.286 448 HE22 GLN 58 HE22 GLN 58 7.174 13.905 -6.204 449 H GLU 59 HN GLU 59 5.759 10.253 -1.581 450 HA GLU 59 HA GLU 59 7.612 8.594 -2.849 451 HB2 GLU 59 HB2 GLU 59 7.275 8.959 0.057 452 HB3 GLU 59 HB1 GLU 59 8.750 8.547 -0.778 453 HG2 GLU 59 HG2 GLU 59 7.259 11.138 -1.116 454 HG3 GLU 59 HG1 GLU 59 8.635 10.912 -0.051 455 H MET 60 HN MET 60 4.921 7.869 -0.730 456 HA MET 60 HA MET 60 5.596 5.150 -0.284 457 HB2 MET 60 HB2 MET 60 2.768 5.919 -0.294 458 HB3 MET 60 HB1 MET 60 3.649 4.964 0.855 459 HG2 MET 60 HG2 MET 60 4.774 7.262 1.423 460 HG3 MET 60 HG1 MET 60 3.288 7.898 0.743 461 HE1 MET 60 HE1 MET 60 0.619 6.208 3.130 462 HE2 MET 60 HE2 MET 60 1.187 5.714 1.533 463 HE3 MET 60 HE3 MET 60 0.834 7.407 1.852 464 H ILE 61 HN ILE 61 3.678 6.873 -2.625 465 HA ILE 61 HA ILE 61 2.813 4.645 -4.145 466 HB ILE 61 HB ILE 61 3.176 7.545 -4.885 467 HG12 ILE 61 HG12 ILE 61 1.040 5.848 -3.684 468 HG13 ILE 61 HG11 ILE 61 1.529 7.490 -3.283 469 HG21 ILE 61 HG21 ILE 61 1.753 7.098 -6.808 470 HG22 ILE 61 HG22 ILE 61 1.712 5.379 -6.405 471 HG23 ILE 61 HG23 ILE 61 3.230 6.133 -6.901 472 HD11 ILE 61 HD11 ILE 61 -0.660 7.494 -4.228 473 HD12 ILE 61 HD12 ILE 61 -0.082 6.608 -5.642 474 HD13 ILE 61 HD13 ILE 61 0.464 8.265 -5.349 475 H ASP 62 HN ASP 62 5.620 6.788 -4.323 476 HA ASP 62 HA ASP 62 6.643 6.011 -6.786 477 HB2 ASP 62 HB2 ASP 62 7.475 7.963 -5.679 478 HB3 ASP 62 HB1 ASP 62 8.034 7.016 -4.304 479 H GLU 63 HN GLU 63 7.023 4.457 -3.638 480 HA GLU 63 HA GLU 63 9.056 2.664 -3.977 481 HB2 GLU 63 HB2 GLU 63 6.360 2.043 -2.874 482 HB3 GLU 63 HB1 GLU 63 7.808 1.105 -2.589 483 HG2 GLU 63 HG2 GLU 63 7.288 3.925 -1.708 484 HG3 GLU 63 HG1 GLU 63 7.311 2.475 -0.723 485 H VAL 64 HN VAL 64 5.843 2.556 -5.227 486 HA VAL 64 HA VAL 64 6.232 -0.112 -6.378 487 HB VAL 64 HB VAL 64 3.839 -0.354 -6.229 488 HG11 VAL 64 HG11 VAL 64 3.500 -0.066 -3.801 489 HG12 VAL 64 HG12 VAL 64 4.982 0.897 -3.722 490 HG13 VAL 64 HG13 VAL 64 5.052 -0.805 -4.188 491 HG21 VAL 64 HG21 VAL 64 2.762 1.563 -6.707 492 HG22 VAL 64 HG22 VAL 64 3.991 2.556 -5.920 493 HG23 VAL 64 HG23 VAL 64 2.767 1.745 -4.942 494 H ASP 65 HN ASP 65 5.789 3.171 -7.066 495 HA ASP 65 HA ASP 65 4.244 3.123 -9.401 496 HB2 ASP 65 HB2 ASP 65 4.525 5.134 -8.067 497 HB3 ASP 65 HB1 ASP 65 6.232 5.124 -8.391 498 H GLU 66 HN GLU 66 5.143 1.399 -10.630 499 HA GLU 66 HA GLU 66 7.785 1.662 -11.701 500 HB2 GLU 66 HB2 GLU 66 5.540 -0.262 -12.216 501 HB3 GLU 66 HB1 GLU 66 7.131 -0.397 -12.883 502 HG2 GLU 66 HG2 GLU 66 8.093 -0.643 -10.691 503 HG3 GLU 66 HG1 GLU 66 6.499 -0.440 -9.990 504 H ASP 67 HN ASP 67 4.574 2.597 -12.576 505 HA ASP 67 HA ASP 67 5.233 2.824 -15.408 506 HB2 ASP 67 HB2 ASP 67 3.017 1.984 -14.759 507 HB3 ASP 67 HB1 ASP 67 2.684 3.496 -13.923 508 H GLY 68 HN GLY 68 5.652 4.665 -12.690 509 HA2 GLY 68 HA2 GLY 68 6.309 6.838 -12.360 510 HA3 GLY 68 HA1 GLY 68 6.497 6.970 -14.103 511 H SER 69 HN SER 69 3.524 6.111 -12.498 512 HA SER 69 HA SER 69 2.228 8.307 -13.926 513 HB2 SER 69 HB2 SER 69 1.371 6.040 -14.308 514 HB3 SER 69 HB1 SER 69 1.084 5.847 -12.580 515 HG SER 69 HG SER 69 -0.727 6.877 -12.787 516 H GLY 70 HN GLY 70 3.169 7.368 -10.780 517 HA2 GLY 70 HA2 GLY 70 2.933 8.537 -8.788 518 HA3 GLY 70 HA1 GLY 70 1.939 9.714 -9.638 519 H THR 71 HN THR 71 1.051 6.457 -10.018 520 HA THR 71 HA THR 71 -0.928 6.557 -7.861 521 HB THR 71 HB THR 71 -2.586 5.526 -9.537 522 HG1 THR 71 HG1 THR 71 -1.142 5.085 -11.221 523 HG21 THR 71 HG21 THR 71 -2.826 7.881 -8.775 524 HG22 THR 71 HG22 THR 71 -3.362 7.640 -10.443 525 HG23 THR 71 HG23 THR 71 -1.796 8.390 -10.116 526 H VAL 72 HN VAL 72 -1.485 4.592 -7.068 527 HA VAL 72 HA VAL 72 0.064 2.289 -7.993 528 HB VAL 72 HB VAL 72 -1.503 2.893 -5.527 529 HG11 VAL 72 HG11 VAL 72 -1.489 0.607 -4.785 530 HG12 VAL 72 HG12 VAL 72 -0.579 0.102 -6.201 531 HG13 VAL 72 HG13 VAL 72 -2.261 0.612 -6.371 532 HG21 VAL 72 HG21 VAL 72 1.084 3.066 -6.111 533 HG22 VAL 72 HG22 VAL 72 1.014 1.419 -5.435 534 HG23 VAL 72 HG23 VAL 72 0.426 2.793 -4.514 535 H ASP 73 HN ASP 73 -0.775 0.635 -9.092 536 HA ASP 73 HA ASP 73 -3.711 0.353 -9.070 537 HB2 ASP 73 HB2 ASP 73 -3.605 -0.693 -11.133 538 HB3 ASP 73 HB1 ASP 73 -2.367 0.532 -11.277 539 H PHE 74 HN PHE 74 -4.080 -2.279 -9.491 540 HA PHE 74 HA PHE 74 -4.092 -3.057 -6.850 541 HB2 PHE 74 HB2 PHE 74 -5.651 -3.978 -8.389 542 HB3 PHE 74 HB1 PHE 74 -4.368 -4.724 -9.331 543 HD1 PHE 74 HD1 PHE 74 -5.153 -6.935 -9.246 544 HD2 PHE 74 HD2 PHE 74 -4.547 -4.776 -5.620 545 HE1 PHE 74 HE1 PHE 74 -5.382 -9.012 -7.964 546 HE2 PHE 74 HE2 PHE 74 -4.754 -6.864 -4.348 547 HZ PHE 74 HZ PHE 74 -5.213 -8.982 -5.518 548 H ASP 75 HN ASP 75 -1.864 -4.332 -9.370 549 HA ASP 75 HA ASP 75 -0.622 -6.102 -7.521 550 HB2 ASP 75 HB2 ASP 75 -0.593 -6.378 -10.028 551 HB3 ASP 75 HB1 ASP 75 0.588 -5.072 -10.082 552 H GLU 76 HN GLU 76 -0.025 -2.792 -8.513 553 HA GLU 76 HA GLU 76 2.483 -2.404 -7.368 554 HB2 GLU 76 HB2 GLU 76 0.293 -0.456 -7.516 555 HB3 GLU 76 HB1 GLU 76 1.966 -0.057 -7.334 556 HG2 GLU 76 HG2 GLU 76 2.213 -1.361 -9.545 557 HG3 GLU 76 HG1 GLU 76 0.477 -1.060 -9.647 558 H PHE 77 HN PHE 77 -0.684 -1.724 -6.096 559 HA PHE 77 HA PHE 77 -0.101 -1.176 -3.427 560 HB2 PHE 77 HB2 PHE 77 -2.385 -1.051 -4.592 561 HB3 PHE 77 HB1 PHE 77 -2.482 -2.789 -4.340 562 HD1 PHE 77 HD1 PHE 77 -2.012 0.398 -2.471 563 HD2 PHE 77 HD2 PHE 77 -3.288 -3.662 -2.419 564 HE1 PHE 77 HE1 PHE 77 -2.842 0.688 -0.176 565 HE2 PHE 77 HE2 PHE 77 -4.118 -3.379 -0.122 566 HZ PHE 77 HZ PHE 77 -3.884 -1.196 1.007 567 H LEU 78 HN LEU 78 -0.372 -4.189 -5.163 568 HA LEU 78 HA LEU 78 -0.795 -5.760 -2.821 569 HB2 LEU 78 HB2 LEU 78 -1.156 -6.095 -5.557 570 HB3 LEU 78 HB1 LEU 78 -0.009 -7.314 -5.073 571 HG LEU 78 HG LEU 78 -2.794 -6.932 -4.082 572 HD11 LEU 78 HD11 LEU 78 -2.596 -8.244 -6.045 573 HD12 LEU 78 HD12 LEU 78 -2.877 -9.326 -4.686 574 HD13 LEU 78 HD13 LEU 78 -1.265 -9.153 -5.354 575 HD21 LEU 78 HD21 LEU 78 -1.932 -9.080 -2.714 576 HD22 LEU 78 HD22 LEU 78 -1.992 -7.442 -2.049 577 HD23 LEU 78 HD23 LEU 78 -0.474 -8.083 -2.685 578 H VAL 79 HN VAL 79 2.010 -5.357 -5.029 579 HA VAL 79 HA VAL 79 3.661 -7.081 -3.533 580 HB VAL 79 HB VAL 79 4.334 -4.844 -5.380 581 HG11 VAL 79 HG11 VAL 79 6.628 -5.056 -4.958 582 HG12 VAL 79 HG12 VAL 79 6.396 -6.515 -4.010 583 HG13 VAL 79 HG13 VAL 79 5.924 -4.953 -3.344 584 HG21 VAL 79 HG21 VAL 79 3.730 -7.166 -6.079 585 HG22 VAL 79 HG22 VAL 79 5.235 -7.654 -5.261 586 HG23 VAL 79 HG23 VAL 79 5.287 -6.532 -6.631 587 H MET 80 HN MET 80 3.094 -3.619 -3.339 588 HA MET 80 HA MET 80 4.844 -3.202 -1.207 589 HB2 MET 80 HB2 MET 80 4.155 -1.248 -2.274 590 HB3 MET 80 HB1 MET 80 2.465 -1.724 -2.288 591 HG2 MET 80 HG2 MET 80 3.852 -1.127 0.288 592 HG3 MET 80 HG1 MET 80 3.246 0.169 -0.737 593 HE1 MET 80 HE1 MET 80 0.724 -0.363 2.357 594 HE2 MET 80 HE2 MET 80 2.028 0.647 1.739 595 HE3 MET 80 HE3 MET 80 2.386 -0.941 2.407 596 H MET 81 HN MET 81 1.499 -4.258 -1.376 597 HA MET 81 HA MET 81 0.811 -4.216 1.307 598 HB2 MET 81 HB2 MET 81 -0.169 -5.554 -1.050 599 HB3 MET 81 HB1 MET 81 -0.230 -6.619 0.339 600 HG2 MET 81 HG2 MET 81 -1.621 -3.999 -0.035 601 HG3 MET 81 HG1 MET 81 -2.315 -5.589 0.179 602 HE1 MET 81 HE1 MET 81 0.270 -3.304 2.696 603 HE2 MET 81 HE2 MET 81 -1.237 -2.547 3.218 604 HE3 MET 81 HE3 MET 81 -0.817 -2.578 1.508 605 H VAL 82 HN VAL 82 2.108 -7.010 -0.482 606 HA VAL 82 HA VAL 82 2.573 -8.521 1.848 607 HB VAL 82 HB VAL 82 2.412 -9.668 -0.274 608 HG11 VAL 82 HG11 VAL 82 3.274 -8.061 -1.799 609 HG12 VAL 82 HG12 VAL 82 4.267 -9.515 -1.942 610 HG13 VAL 82 HG13 VAL 82 4.857 -8.121 -1.036 611 HG21 VAL 82 HG21 VAL 82 4.312 -11.154 -0.151 612 HG22 VAL 82 HG22 VAL 82 3.815 -10.697 1.477 613 HG23 VAL 82 HG23 VAL 82 5.233 -9.947 0.745 614 H ARG 83 HN ARG 83 4.396 -6.057 0.239 615 HA ARG 83 HA ARG 83 6.906 -6.515 1.465 616 HB2 ARG 83 HB2 ARG 83 6.506 -5.092 -0.550 617 HB3 ARG 83 HB1 ARG 83 5.783 -3.901 0.516 618 HG2 ARG 83 HG2 ARG 83 7.949 -3.819 1.762 619 HG3 ARG 83 HG1 ARG 83 8.627 -4.833 0.492 620 HD2 ARG 83 HD2 ARG 83 8.163 -3.157 -1.169 621 HD3 ARG 83 HD1 ARG 83 7.335 -2.157 0.024 622 HE ARG 83 HE ARG 83 10.151 -2.823 0.494 623 HH11 ARG 83 HH11 ARG 83 7.758 -0.426 -0.439 624 HH12 ARG 83 HH12 ARG 83 8.855 0.912 -0.256 625 HH21 ARG 83 HH21 ARG 83 11.547 -1.064 0.759 626 HH22 ARG 83 HH22 ARG 83 10.983 0.553 0.441 627 H SER 84 HN SER 84 4.206 -4.362 2.275 628 HA SER 84 HA SER 84 5.508 -3.136 4.472 629 HB2 SER 84 HB2 SER 84 3.113 -2.376 5.025 630 HB3 SER 84 HB1 SER 84 3.770 -1.885 3.466 631 HG SER 84 HG SER 84 2.520 -3.379 2.459 632 H MET 85 HN MET 85 3.292 -5.864 4.196 633 HA MET 85 HA MET 85 2.983 -6.122 7.023 634 HB2 MET 85 HB2 MET 85 1.776 -8.196 6.505 635 HB3 MET 85 HB1 MET 85 1.198 -6.828 5.564 636 HG2 MET 85 HG2 MET 85 2.564 -7.582 3.683 637 HG3 MET 85 HG1 MET 85 3.038 -8.993 4.612 638 HE1 MET 85 HE1 MET 85 -0.542 -7.269 4.545 639 HE2 MET 85 HE2 MET 85 -1.261 -8.123 3.180 640 HE3 MET 85 HE3 MET 85 0.123 -7.061 2.927 641 H LYS 86 HN LYS 86 5.060 -7.630 4.598 642 HA LYS 86 HA LYS 86 6.212 -9.487 6.431 643 HB2 LYS 86 HB2 LYS 86 6.625 -8.692 3.648 644 HB3 LYS 86 HB1 LYS 86 8.074 -9.209 4.483 645 HG2 LYS 86 HG2 LYS 86 7.205 -11.105 3.401 646 HG3 LYS 86 HG1 LYS 86 6.829 -11.296 5.108 647 HD2 LYS 86 HD2 LYS 86 4.555 -10.766 4.778 648 HD3 LYS 86 HD1 LYS 86 4.864 -10.127 3.160 649 HE2 LYS 86 HE2 LYS 86 3.849 -12.278 2.908 650 HE3 LYS 86 HE1 LYS 86 5.550 -12.423 2.463 651 HZ1 LYS 86 HZ1 LYS 86 4.770 -14.260 3.857 652 HZ2 LYS 86 HZ2 LYS 86 4.425 -13.172 5.104 653 HZ3 LYS 86 HZ3 LYS 86 6.020 -13.392 4.593 654 H ASP 87 HN ASP 87 6.673 -6.221 5.625 655 HA ASP 87 HA ASP 87 8.059 -4.584 6.308 656 HB2 ASP 87 HB2 ASP 87 7.978 -5.586 8.570 657 HB3 ASP 87 HB1 ASP 87 9.332 -6.624 8.139 658 H ASP 88 HN ASP 88 10.083 -3.751 5.720 659 HA ASP 88 HA ASP 88 11.098 -5.206 3.459 660 HB2 ASP 88 HB2 ASP 88 10.550 -2.719 3.554 661 HB3 ASP 88 HB1 ASP 88 12.083 -2.528 4.400 662 H SER 89 HN SER 89 12.047 -4.976 6.695 663 HA SER 89 HA SER 89 14.899 -4.930 6.274 664 HB2 SER 89 HB2 SER 89 13.513 -5.723 8.827 665 HB3 SER 89 HB1 SER 89 15.092 -4.969 8.624 666 HG SER 89 HG SER 89 12.521 -3.835 8.336 667 H LYS 90 HN LYS 90 13.455 -7.136 4.967 668 HA LYS 90 HA LYS 90 14.242 -9.545 6.257 669 HB2 LYS 90 HB2 LYS 90 12.588 -9.489 4.408 670 HB3 LYS 90 HB1 LYS 90 13.868 -9.008 3.310 671 HG2 LYS 90 HG2 LYS 90 13.369 -11.369 3.097 672 HG3 LYS 90 HG1 LYS 90 15.010 -11.126 3.696 673 HD2 LYS 90 HD2 LYS 90 14.104 -11.468 6.013 674 HD3 LYS 90 HD1 LYS 90 12.573 -11.935 5.274 675 HE2 LYS 90 HE2 LYS 90 15.233 -13.279 4.816 676 HE3 LYS 90 HE1 LYS 90 13.954 -13.877 5.869 677 HZ1 LYS 90 HZ1 LYS 90 13.724 -13.487 2.934 678 HZ2 LYS 90 HZ2 LYS 90 12.511 -14.085 3.951 679 HZ3 LYS 90 HZ3 LYS 90 13.930 -14.970 3.716 680 H GLY 136 HN GLY 136 15.682 -7.384 3.892 681 HA2 GLY 136 HA2 GLY 136 18.272 -8.708 4.196 682 HA3 GLY 136 HA1 GLY 136 17.883 -7.445 3.036 683 H LYS 137 HN LYS 137 16.772 -6.981 6.204 684 HA LYS 137 HA LYS 137 17.293 -5.638 7.912 685 HB2 LYS 137 HB2 LYS 137 19.961 -6.658 7.100 686 HB3 LYS 137 HB1 LYS 137 19.900 -5.337 8.263 687 HG2 LYS 137 HG2 LYS 137 20.012 -7.620 9.266 688 HG3 LYS 137 HG1 LYS 137 18.648 -6.641 9.805 689 HD2 LYS 137 HD2 LYS 137 17.175 -7.814 8.255 690 HD3 LYS 137 HD1 LYS 137 18.540 -8.777 7.676 691 HE2 LYS 137 HE2 LYS 137 18.826 -9.735 9.901 692 HE3 LYS 137 HE1 LYS 137 17.495 -8.750 10.506 693 HZ1 LYS 137 HZ1 LYS 137 15.988 -9.910 9.049 694 HZ2 LYS 137 HZ2 LYS 137 16.816 -11.025 10.008 695 HZ3 LYS 137 HZ3 LYS 137 17.254 -10.817 8.390 696 H PHE 138 HN PHE 138 20.217 -4.261 7.130 697 HA PHE 138 HA PHE 138 18.821 -1.741 7.259 698 HB2 PHE 138 HB2 PHE 138 21.774 -2.351 7.378 699 HB3 PHE 138 HB1 PHE 138 21.018 -0.814 7.767 700 HD1 PHE 138 HD1 PHE 138 21.967 -4.042 8.981 701 HD2 PHE 138 HD2 PHE 138 19.423 -0.710 9.719 702 HE1 PHE 138 HE1 PHE 138 21.682 -4.780 11.309 703 HE2 PHE 138 HE2 PHE 138 19.137 -1.442 12.048 704 HZ PHE 138 HZ PHE 138 20.267 -3.478 12.844 705 H LYS 139 HN LYS 139 18.087 -2.242 4.931 706 HA LYS 139 HA LYS 139 19.424 -0.186 3.427 707 HB2 LYS 139 HB2 LYS 139 19.598 -1.586 1.341 708 HB3 LYS 139 HB1 LYS 139 20.747 -2.018 2.600 709 HG2 LYS 139 HG2 LYS 139 19.639 -3.999 3.108 710 HG3 LYS 139 HG1 LYS 139 18.139 -3.466 2.350 711 HD2 LYS 139 HD2 LYS 139 19.252 -3.571 0.148 712 HD3 LYS 139 HD1 LYS 139 20.706 -4.187 0.940 713 HE2 LYS 139 HE2 LYS 139 18.021 -5.530 1.166 714 HE3 LYS 139 HE1 LYS 139 19.179 -5.918 -0.107 715 HZ1 LYS 139 HZ1 LYS 139 20.774 -6.554 1.575 716 HZ2 LYS 139 HZ2 LYS 139 19.346 -7.433 1.775 717 HZ3 LYS 139 HZ3 LYS 139 19.696 -6.142 2.811 718 H ARG 140 HN ARG 140 17.059 0.124 4.475 719 HA ARG 140 HA ARG 140 15.161 -0.544 2.348 720 HB2 ARG 140 HB2 ARG 140 13.451 -0.112 4.299 721 HB3 ARG 140 HB1 ARG 140 14.128 -1.685 3.960 722 HG2 ARG 140 HG2 ARG 140 14.191 -1.365 6.313 723 HG3 ARG 140 HG1 ARG 140 15.846 -1.249 5.720 724 HD2 ARG 140 HD2 ARG 140 15.681 1.204 5.800 725 HD3 ARG 140 HD1 ARG 140 14.038 1.063 6.429 726 HE ARG 140 HE ARG 140 15.494 -0.401 8.179 727 HH11 ARG 140 HH11 ARG 140 15.825 2.853 6.949 728 HH12 ARG 140 HH12 ARG 140 16.553 3.466 8.395 729 HH21 ARG 140 HH21 ARG 140 16.444 0.406 10.101 730 HH22 ARG 140 HH22 ARG 140 16.914 2.071 10.189 731 HA PRO 141 HA PRO 141 14.194 3.767 1.912 732 HB2 PRO 141 HB2 PRO 141 12.106 2.875 0.129 733 HB3 PRO 141 HB1 PRO 141 13.651 3.611 -0.291 734 HG2 PRO 141 HG2 PRO 141 13.037 1.015 -0.858 735 HG3 PRO 141 HG1 PRO 141 14.682 1.589 -0.595 736 HD2 PRO 141 HD2 PRO 141 12.800 0.241 1.299 737 HD3 PRO 141 HD1 PRO 141 14.492 -0.087 0.957 738 H THR 142 HN THR 142 12.718 4.996 3.065 739 HA THR 142 HA THR 142 10.147 3.800 3.701 740 HB THR 142 HB THR 142 11.606 4.964 6.021 741 HG1 THR 142 HG1 THR 142 11.941 2.300 6.041 742 HG21 THR 142 HG21 THR 142 9.655 2.673 5.730 743 HG22 THR 142 HG22 THR 142 9.247 4.318 6.217 744 HG23 THR 142 HG23 THR 142 10.268 3.320 7.251 745 H LEU 143 HN LEU 143 12.290 6.603 3.953 746 HA LEU 143 HA LEU 143 11.902 8.838 4.114 747 HB2 LEU 143 HB2 LEU 143 10.817 8.567 1.991 748 HB3 LEU 143 HB1 LEU 143 9.356 7.974 2.755 749 HG LEU 143 HG LEU 143 9.853 10.555 3.825 750 HD11 LEU 143 HD11 LEU 143 10.180 10.417 0.853 751 HD12 LEU 143 HD12 LEU 143 11.219 11.221 2.035 752 HD13 LEU 143 HD13 LEU 143 9.605 11.867 1.690 753 HD21 LEU 143 HD21 LEU 143 7.734 11.091 2.666 754 HD22 LEU 143 HD22 LEU 143 7.669 9.613 3.626 755 HD23 LEU 143 HD23 LEU 143 7.817 9.521 1.871 756 H ARG 144 HN ARG 144 11.831 9.188 6.305 757 HA ARG 144 HA ARG 144 9.596 8.387 7.887 758 HB2 ARG 144 HB2 ARG 144 11.898 8.487 8.791 759 HB3 ARG 144 HB1 ARG 144 11.868 10.241 8.626 760 HG2 ARG 144 HG2 ARG 144 10.001 10.356 10.197 761 HG3 ARG 144 HG1 ARG 144 10.043 8.603 10.374 762 HD2 ARG 144 HD2 ARG 144 12.312 8.751 11.264 763 HD3 ARG 144 HD1 ARG 144 12.275 10.504 11.076 764 HE ARG 144 HE ARG 144 10.082 9.905 12.602 765 HH11 ARG 144 HH11 ARG 144 13.532 9.392 12.911 766 HH12 ARG 144 HH12 ARG 144 13.497 9.403 14.646 767 HH21 ARG 144 HH21 ARG 144 10.039 9.919 14.869 768 HH22 ARG 144 HH22 ARG 144 11.512 9.710 15.759 769 H ARG 145 HN ARG 145 8.005 9.504 6.565 770 HA ARG 145 HA ARG 145 7.601 12.250 7.554 771 HB2 ARG 145 HB2 ARG 145 6.855 10.908 4.985 772 HB3 ARG 145 HB1 ARG 145 5.893 12.257 5.580 773 HG2 ARG 145 HG2 ARG 145 8.855 12.365 5.179 774 HG3 ARG 145 HG1 ARG 145 7.674 12.890 3.972 775 HD2 ARG 145 HD2 ARG 145 8.205 14.846 5.073 776 HD3 ARG 145 HD1 ARG 145 6.727 14.323 5.886 777 HE ARG 145 HE ARG 145 9.190 13.443 7.127 778 HH11 ARG 145 HH11 ARG 145 6.728 15.925 6.981 779 HH12 ARG 145 HH12 ARG 145 7.028 16.498 8.590 780 HH21 ARG 145 HH21 ARG 145 9.592 14.190 9.238 781 HH22 ARG 145 HH22 ARG 145 8.663 15.506 9.882 782 H VAL 146 HN VAL 146 5.909 9.401 6.459 783 HA VAL 146 HA VAL 146 4.214 9.203 8.764 784 HB VAL 146 HB VAL 146 2.150 9.133 7.146 785 HG11 VAL 146 HG11 VAL 146 3.212 11.870 7.791 786 HG12 VAL 146 HG12 VAL 146 2.529 10.787 9.012 787 HG13 VAL 146 HG13 VAL 146 1.522 11.344 7.671 788 HG21 VAL 146 HG21 VAL 146 2.278 10.767 5.333 789 HG22 VAL 146 HG22 VAL 146 3.412 9.438 5.093 790 HG23 VAL 146 HG23 VAL 146 3.988 11.002 5.671 791 H ARG 147 HN ARG 147 3.512 7.053 8.938 792 HA ARG 147 HA ARG 147 4.192 5.371 6.628 793 HB2 ARG 147 HB2 ARG 147 5.839 5.458 8.695 794 HB3 ARG 147 HB1 ARG 147 4.676 4.326 9.377 795 HG2 ARG 147 HG2 ARG 147 5.998 3.946 6.704 796 HG3 ARG 147 HG1 ARG 147 6.619 3.272 8.210 797 HD2 ARG 147 HD2 ARG 147 3.805 2.773 7.323 798 HD3 ARG 147 HD1 ARG 147 5.129 1.792 6.713 799 HE ARG 147 HE ARG 147 4.537 2.064 9.596 800 HH11 ARG 147 HH11 ARG 147 5.292 0.107 6.799 801 HH12 ARG 147 HH12 ARG 147 5.425 -1.366 7.696 802 HH21 ARG 147 HH21 ARG 147 4.669 0.118 10.787 803 HH22 ARG 147 HH22 ARG 147 5.060 -1.362 9.972 804 H ILE 148 HN ILE 148 2.585 4.168 5.978 805 HA ILE 148 HA ILE 148 0.302 3.649 7.700 806 HB ILE 148 HB ILE 148 0.773 3.702 4.833 807 HG12 ILE 148 HG12 ILE 148 -1.690 3.888 6.578 808 HG13 ILE 148 HG11 ILE 148 -0.736 5.212 5.977 809 HG21 ILE 148 HG21 ILE 148 -0.866 1.421 5.925 810 HG22 ILE 148 HG22 ILE 148 0.573 1.307 4.909 811 HG23 ILE 148 HG23 ILE 148 -0.923 1.986 4.254 812 HD11 ILE 148 HD11 ILE 148 -2.575 3.424 4.471 813 HD12 ILE 148 HD12 ILE 148 -1.314 4.328 3.648 814 HD13 ILE 148 HD13 ILE 148 -2.559 5.187 4.560 815 H SER 149 HN SER 149 -0.066 1.778 8.732 816 HA SER 149 HA SER 149 1.719 -0.464 8.303 817 HB2 SER 149 HB2 SER 149 -0.720 -0.388 10.076 818 HB3 SER 149 HB1 SER 149 0.626 -1.510 10.148 819 HG SER 149 HG SER 149 1.180 1.212 10.410 820 H ALA 150 HN ALA 150 1.096 -2.464 7.439 821 HA ALA 150 HA ALA 150 -0.461 -2.279 5.161 822 HB1 ALA 150 HB1 ALA 150 0.215 -4.804 6.660 823 HB2 ALA 150 HB2 ALA 150 1.285 -3.967 5.533 824 HB3 ALA 150 HB3 ALA 150 -0.223 -4.677 4.957 825 H ASP 151 HN ASP 151 -1.321 -4.194 8.034 826 HA ASP 151 HA ASP 151 -3.988 -4.638 7.088 827 HB2 ASP 151 HB2 ASP 151 -2.814 -5.088 9.831 828 HB3 ASP 151 HB1 ASP 151 -4.368 -5.685 9.267 829 H ALA 152 HN ALA 152 -2.525 -2.368 9.377 830 HA ALA 152 HA ALA 152 -4.980 -1.588 10.542 831 HB1 ALA 152 HB1 ALA 152 -2.689 -1.161 11.494 832 HB2 ALA 152 HB2 ALA 152 -3.843 0.163 11.592 833 HB3 ALA 152 HB3 ALA 152 -2.573 0.194 10.368 834 H MET 153 HN MET 153 -3.077 -0.263 7.852 835 HA MET 153 HA MET 153 -4.857 1.789 7.131 836 HB2 MET 153 HB2 MET 153 -2.972 1.959 5.867 837 HB3 MET 153 HB1 MET 153 -2.765 0.213 5.758 838 HG2 MET 153 HG2 MET 153 -5.139 1.125 4.378 839 HG3 MET 153 HG1 MET 153 -3.672 1.878 3.768 840 HE1 MET 153 HE1 MET 153 -1.389 -0.207 3.893 841 HE2 MET 153 HE2 MET 153 -1.912 0.886 2.611 842 HE3 MET 153 HE3 MET 153 -1.631 -0.823 2.259 843 H MET 154 HN MET 154 -4.530 -1.524 5.990 844 HA MET 154 HA MET 154 -6.615 -1.802 4.270 845 HB2 MET 154 HB2 MET 154 -5.303 -3.622 6.227 846 HB3 MET 154 HB1 MET 154 -6.714 -4.202 5.390 847 HG2 MET 154 HG2 MET 154 -5.633 -3.864 3.254 848 HG3 MET 154 HG1 MET 154 -4.227 -3.169 4.063 849 HE1 MET 154 HE1 MET 154 -6.394 -6.214 5.265 850 HE2 MET 154 HE2 MET 154 -5.537 -7.564 4.522 851 HE3 MET 154 HE3 MET 154 -6.378 -6.389 3.510 852 H GLN 155 HN GLN 155 -6.692 -2.073 7.772 853 HA GLN 155 HA GLN 155 -9.280 -3.065 7.987 854 HB2 GLN 155 HB2 GLN 155 -7.403 -1.747 9.885 855 HB3 GLN 155 HB1 GLN 155 -9.054 -2.137 10.371 856 HG2 GLN 155 HG2 GLN 155 -8.732 -4.438 9.849 857 HG3 GLN 155 HG1 GLN 155 -7.146 -4.102 9.184 858 HE21 GLN 155 HE21 GLN 155 -9.073 -4.076 12.090 859 HE22 GLN 155 HE22 GLN 155 -7.771 -4.273 13.211 860 H ALA 156 HN ALA 156 -8.033 0.174 7.777 861 HA ALA 156 HA ALA 156 -10.209 1.624 8.742 862 HB1 ALA 156 HB1 ALA 156 -9.362 3.496 7.528 863 HB2 ALA 156 HB2 ALA 156 -8.459 2.444 6.436 864 HB3 ALA 156 HB3 ALA 156 -7.994 2.565 8.135 865 H LEU 157 HN LEU 157 -9.490 0.577 5.426 866 HA LEU 157 HA LEU 157 -12.117 1.369 4.477 867 HB2 LEU 157 HB2 LEU 157 -10.573 -0.309 2.683 868 HB3 LEU 157 HB1 LEU 157 -11.223 1.286 2.410 869 HG LEU 157 HG LEU 157 -9.058 1.731 4.103 870 HD11 LEU 157 HD11 LEU 157 -7.239 0.623 2.665 871 HD12 LEU 157 HD12 LEU 157 -8.507 -0.504 2.185 872 HD13 LEU 157 HD13 LEU 157 -8.050 -0.364 3.884 873 HD21 LEU 157 HD21 LEU 157 -9.627 3.199 2.379 874 HD22 LEU 157 HD22 LEU 157 -9.476 1.938 1.153 875 HD23 LEU 157 HD23 LEU 157 -8.042 2.553 1.961 876 H LEU 158 HN LEU 158 -10.524 -1.496 5.543 877 HA LEU 158 HA LEU 158 -11.828 -3.349 3.870 878 HB2 LEU 158 HB2 LEU 158 -9.723 -3.421 5.652 879 HB3 LEU 158 HB1 LEU 158 -10.891 -4.489 6.347 880 HG LEU 158 HG LEU 158 -10.963 -5.454 3.944 881 HD11 LEU 158 HD11 LEU 158 -8.664 -5.383 3.014 882 HD12 LEU 158 HD12 LEU 158 -8.342 -4.075 4.160 883 HD13 LEU 158 HD13 LEU 158 -9.575 -3.869 2.908 884 HD21 LEU 158 HD21 LEU 158 -8.853 -5.914 6.004 885 HD22 LEU 158 HD22 LEU 158 -9.043 -6.939 4.583 886 HD23 LEU 158 HD23 LEU 158 -10.348 -6.819 5.760 887 H GLY 159 HN GLY 159 -13.649 -1.642 5.686 888 HA2 GLY 159 HA2 GLY 159 -14.850 -3.125 7.666 889 HA3 GLY 159 HA1 GLY 159 -15.728 -2.023 6.621 890 H ALA 160 HN ALA 160 -14.871 -3.804 4.299 891 HA ALA 160 HA ALA 160 -17.107 -5.509 4.129 892 HB1 ALA 160 HB1 ALA 160 -15.989 -4.596 2.174 893 HB2 ALA 160 HB2 ALA 160 -16.006 -6.359 2.105 894 HB3 ALA 160 HB3 ALA 160 -14.530 -5.504 2.562 895 H ARG 161 HN ARG 161 -13.748 -6.077 5.112 896 HA ARG 161 HA ARG 161 -14.398 -8.673 6.185 897 HB2 ARG 161 HB2 ARG 161 -12.767 -9.916 4.805 898 HB3 ARG 161 HB1 ARG 161 -14.095 -9.299 3.843 899 HG2 ARG 161 HG2 ARG 161 -12.664 -7.432 3.109 900 HG3 ARG 161 HG1 ARG 161 -11.324 -8.145 4.015 901 HD2 ARG 161 HD2 ARG 161 -11.020 -8.919 1.829 902 HD3 ARG 161 HD1 ARG 161 -11.782 -10.258 2.682 903 HE ARG 161 HE ARG 161 -13.288 -8.417 0.944 904 HH11 ARG 161 HH11 ARG 161 -12.543 -11.653 2.082 905 HH12 ARG 161 HH12 ARG 161 -13.703 -12.420 1.046 906 HH21 ARG 161 HH21 ARG 161 -14.803 -9.429 -0.433 907 HH22 ARG 161 HH22 ARG 161 -14.989 -11.153 -0.384 908 H ALA 162 HN ALA 162 -13.406 -6.324 7.375 909 HA ALA 162 HA ALA 162 -10.559 -6.324 7.504 910 HB1 ALA 162 HB1 ALA 162 -11.817 -4.276 7.863 911 HB2 ALA 162 HB2 ALA 162 -10.805 -4.656 9.255 912 HB3 ALA 162 HB3 ALA 162 -12.540 -4.967 9.319 913 H LYS 163 HN LYS 163 -9.213 -7.143 8.968 914 HA LYS 163 HA LYS 163 -10.293 -8.683 11.188 915 HB2 LYS 163 HB2 LYS 163 -9.194 -10.699 10.613 916 HB3 LYS 163 HB1 LYS 163 -10.022 -10.193 9.152 917 HG2 LYS 163 HG2 LYS 163 -7.091 -9.844 9.743 918 HG3 LYS 163 HG1 LYS 163 -7.795 -11.077 8.699 919 HD2 LYS 163 HD2 LYS 163 -7.941 -9.662 6.979 920 HD3 LYS 163 HD1 LYS 163 -8.646 -8.392 7.982 921 HE2 LYS 163 HE2 LYS 163 -6.625 -7.470 7.295 922 HE3 LYS 163 HE1 LYS 163 -6.275 -8.101 8.910 923 HZ1 LYS 163 HZ1 LYS 163 -4.527 -8.661 7.334 924 HZ2 LYS 163 HZ2 LYS 163 -5.646 -9.468 6.340 925 HZ3 LYS 163 HZ3 LYS 163 -5.301 -10.063 7.889 926 H GLY 164 HN GLY 164 -8.447 -9.479 12.579 927 HA2 GLY 164 HA2 GLY 164 -6.094 -9.092 13.164 928 HA3 GLY 164 HA1 GLY 164 -6.298 -7.460 12.543 929 H HIS 165 HN HIS 165 -8.837 -8.941 14.348 930 HA HIS 165 HA HIS 165 -8.395 -7.036 16.533 931 HB2 HIS 165 HB2 HIS 165 -10.826 -8.681 15.789 932 HB3 HIS 165 HB1 HIS 165 -10.737 -7.622 17.190 933 HD1 HIS 165 HD1 HIS 165 -11.429 -5.261 16.834 934 HD2 HIS 165 HD2 HIS 165 -10.604 -7.213 13.256 935 HE1 HIS 165 HE1 HIS 165 -12.115 -3.662 15.017 936 HE2 HIS 165 HE2 HIS 165 -11.512 -4.820 12.863 937 HAB 9XG 201 HAB DRG 201 5.852 4.067 4.770 938 HAC 9XG 201 HAC DRG 201 6.883 4.825 3.534 939 HAA 9XG 201 HAA DRG 201 7.318 3.231 4.205 940 HAD 9XG 201 HAD DRG 201 -1.192 2.424 -2.009 941 HAE 9XG 201 HAE DRG 201 1.120 3.155 -2.579 942 HAF 9XG 201 HAF DRG 201 -1.810 2.052 0.366 943 HAG 9XG 201 HAG DRG 201 6.081 1.102 0.316 944 HAH 9XG 201 HAH DRG 201 7.429 2.199 2.085 945 HAI 9XG 201 HAI DRG 201 2.830 3.331 -0.831 946 HAJ 9XG 201 HAJ DRG 201 -0.114 2.350 2.149 947 HAK 9XG 201 HAK DRG 201 3.652 1.558 0.138 948 HAL 9XG 201 HAL DRG 201 3.904 4.180 3.528 949 HAM 9XG 201 HAM DRG 201 1.935 3.590 2.567 Start of MODEL 4 1 H1 MET 1 HT1 MET 1 9.171 -0.283 -7.314 2 H2 MET 1 HT2 MET 1 10.215 -1.373 -8.070 3 H3 MET 1 HT3 MET 1 10.468 -0.943 -6.453 4 HA MET 1 HA MET 1 8.422 -1.982 -5.809 5 HB2 MET 1 HB2 MET 1 7.045 -1.735 -7.702 6 HB3 MET 1 HB1 MET 1 8.212 -2.491 -8.769 7 HG2 MET 1 HG2 MET 1 7.709 -4.647 -7.937 8 HG3 MET 1 HG1 MET 1 6.801 -4.018 -6.587 9 HE1 MET 1 HE1 MET 1 4.835 -5.552 -7.011 10 HE2 MET 1 HE2 MET 1 3.458 -4.757 -7.782 11 HE3 MET 1 HE3 MET 1 4.374 -3.916 -6.513 12 H ASP 2 HN ASP 2 9.331 -3.362 -4.558 13 HA ASP 2 HA ASP 2 11.535 -4.966 -5.009 14 HB2 ASP 2 HB2 ASP 2 9.229 -5.299 -3.148 15 HB3 ASP 2 HB1 ASP 2 10.664 -6.291 -3.053 16 H ASP 3 HN ASP 3 11.734 -6.517 -6.545 17 HA ASP 3 HA ASP 3 9.460 -7.999 -7.444 18 HB2 ASP 3 HB2 ASP 3 11.014 -9.245 -8.844 19 HB3 ASP 3 HB1 ASP 3 11.261 -7.516 -8.995 20 H ILE 4 HN ILE 4 11.786 -8.324 -4.965 21 HA ILE 4 HA ILE 4 11.552 -11.048 -4.407 22 HB ILE 4 HB ILE 4 13.200 -9.684 -3.278 23 HG12 ILE 4 HG12 ILE 4 11.997 -11.671 -2.052 24 HG13 ILE 4 HG11 ILE 4 13.152 -10.659 -1.194 25 HG21 ILE 4 HG21 ILE 4 12.422 -8.089 -1.473 26 HG22 ILE 4 HG22 ILE 4 10.838 -8.196 -2.246 27 HG23 ILE 4 HG23 ILE 4 12.223 -7.590 -3.151 28 HD11 ILE 4 HD11 ILE 4 11.174 -11.122 0.149 29 HD12 ILE 4 HD12 ILE 4 10.163 -10.381 -1.092 30 HD13 ILE 4 HD13 ILE 4 11.330 -9.402 -0.206 31 H TYR 5 HN TYR 5 9.611 -8.284 -3.333 32 HA TYR 5 HA TYR 5 7.642 -10.003 -2.121 33 HB2 TYR 5 HB2 TYR 5 7.686 -7.016 -2.619 34 HB3 TYR 5 HB1 TYR 5 6.330 -7.865 -1.867 35 HD1 TYR 5 HD1 TYR 5 9.391 -6.176 -1.167 36 HD2 TYR 5 HD2 TYR 5 6.902 -9.360 0.118 37 HE1 TYR 5 HE1 TYR 5 10.434 -6.093 1.047 38 HE2 TYR 5 HE2 TYR 5 7.914 -9.295 2.321 39 HH TYR 5 HH TYR 5 9.884 -6.737 3.383 40 H LYS 6 HN LYS 6 8.217 -8.473 -5.177 41 HA LYS 6 HA LYS 6 5.592 -8.480 -6.198 42 HB2 LYS 6 HB2 LYS 6 7.675 -7.401 -7.212 43 HB3 LYS 6 HB1 LYS 6 8.052 -8.985 -7.879 44 HG2 LYS 6 HG2 LYS 6 6.022 -8.985 -9.107 45 HG3 LYS 6 HG1 LYS 6 5.489 -7.493 -8.372 46 HD2 LYS 6 HD2 LYS 6 7.383 -6.333 -9.427 47 HD3 LYS 6 HD1 LYS 6 7.885 -7.849 -10.181 48 HE2 LYS 6 HE2 LYS 6 5.731 -7.954 -11.364 49 HE3 LYS 6 HE1 LYS 6 5.257 -6.425 -10.630 50 HZ1 LYS 6 HZ1 LYS 6 6.996 -5.300 -11.810 51 HZ2 LYS 6 HZ2 LYS 6 6.103 -6.206 -12.922 52 HZ3 LYS 6 HZ3 LYS 6 7.616 -6.757 -12.410 53 H ALA 7 HN ALA 7 8.059 -10.884 -5.812 54 HA ALA 7 HA ALA 7 6.627 -13.094 -6.989 55 HB1 ALA 7 HB1 ALA 7 9.001 -12.830 -5.136 56 HB2 ALA 7 HB2 ALA 7 8.957 -13.413 -6.812 57 HB3 ALA 7 HB3 ALA 7 8.272 -14.404 -5.512 58 H ALA 8 HN ALA 8 6.711 -11.549 -3.830 59 HA ALA 8 HA ALA 8 5.561 -13.616 -2.299 60 HB1 ALA 8 HB1 ALA 8 6.557 -11.558 -1.366 61 HB2 ALA 8 HB2 ALA 8 4.977 -11.985 -0.712 62 HB3 ALA 8 HB3 ALA 8 5.121 -10.691 -1.907 63 H VAL 9 HN VAL 9 4.178 -11.116 -4.364 64 HA VAL 9 HA VAL 9 1.441 -11.589 -4.003 65 HB VAL 9 HB VAL 9 2.742 -11.431 -6.736 66 HG11 VAL 9 HG11 VAL 9 0.109 -10.542 -5.652 67 HG12 VAL 9 HG12 VAL 9 0.442 -11.905 -6.737 68 HG13 VAL 9 HG13 VAL 9 0.692 -10.246 -7.291 69 HG21 VAL 9 HG21 VAL 9 3.718 -9.612 -5.704 70 HG22 VAL 9 HG22 VAL 9 2.239 -9.197 -4.833 71 HG23 VAL 9 HG23 VAL 9 2.328 -8.969 -6.588 72 H GLU 10 HN GLU 10 3.869 -13.272 -5.768 73 HA GLU 10 HA GLU 10 2.042 -14.945 -7.098 74 HB2 GLU 10 HB2 GLU 10 5.006 -15.330 -6.973 75 HB3 GLU 10 HB1 GLU 10 3.908 -15.595 -8.347 76 HG2 GLU 10 HG2 GLU 10 3.459 -13.055 -8.010 77 HG3 GLU 10 HG1 GLU 10 4.917 -13.107 -7.172 78 H GLN 11 HN GLN 11 4.088 -14.957 -4.439 79 HA GLN 11 HA GLN 11 3.821 -17.581 -3.477 80 HB2 GLN 11 HB2 GLN 11 5.608 -16.668 -2.523 81 HB3 GLN 11 HB1 GLN 11 5.058 -15.084 -2.938 82 HG2 GLN 11 HG2 GLN 11 3.691 -14.982 -1.069 83 HG3 GLN 11 HG1 GLN 11 4.160 -16.555 -0.593 84 HE21 GLN 11 HE21 GLN 11 6.890 -16.279 -1.287 85 HE22 GLN 11 HE22 GLN 11 7.616 -15.247 -0.110 86 H LEU 12 HN LEU 12 1.788 -14.750 -3.340 87 HA LEU 12 HA LEU 12 0.368 -15.533 -0.995 88 HB2 LEU 12 HB2 LEU 12 -0.510 -13.554 -3.071 89 HB3 LEU 12 HB1 LEU 12 -1.192 -13.782 -1.545 90 HG LEU 12 HG LEU 12 1.627 -12.921 -1.810 91 HD11 LEU 12 HD11 LEU 12 0.954 -10.671 -1.794 92 HD12 LEU 12 HD12 LEU 12 -0.710 -11.087 -1.395 93 HD13 LEU 12 HD13 LEU 12 -0.092 -11.442 -2.992 94 HD21 LEU 12 HD21 LEU 12 1.183 -12.111 0.499 95 HD22 LEU 12 HD22 LEU 12 1.001 -13.850 0.334 96 HD23 LEU 12 HD23 LEU 12 -0.426 -12.826 0.419 97 H THR 13 HN THR 13 -1.926 -16.002 -0.995 98 HA THR 13 HA THR 13 -2.608 -17.893 -3.088 99 HB THR 13 HB THR 13 -4.473 -18.534 -1.678 100 HG1 THR 13 HG1 THR 13 -4.973 -17.485 0.211 101 HG21 THR 13 HG21 THR 13 -2.289 -19.522 -1.112 102 HG22 THR 13 HG22 THR 13 -3.329 -19.355 0.304 103 HG23 THR 13 HG23 THR 13 -2.021 -18.202 0.031 104 H GLU 14 HN GLU 14 -5.059 -17.831 -3.659 105 HA GLU 14 HA GLU 14 -5.688 -15.558 -5.093 106 HB2 GLU 14 HB2 GLU 14 -7.017 -17.290 -5.744 107 HB3 GLU 14 HB1 GLU 14 -7.203 -17.909 -4.109 108 HG2 GLU 14 HG2 GLU 14 -8.801 -16.230 -3.611 109 HG3 GLU 14 HG1 GLU 14 -8.518 -15.460 -5.154 110 H GLU 15 HN GLU 15 -7.026 -16.539 -1.973 111 HA GLU 15 HA GLU 15 -8.499 -14.194 -1.501 112 HB2 GLU 15 HB2 GLU 15 -7.347 -16.123 0.512 113 HB3 GLU 15 HB1 GLU 15 -8.580 -14.918 0.851 114 HG2 GLU 15 HG2 GLU 15 -10.089 -16.026 -0.707 115 HG3 GLU 15 HG1 GLU 15 -8.853 -17.237 -1.036 116 H GLN 16 HN GLN 16 -5.165 -15.032 -0.770 117 HA GLN 16 HA GLN 16 -4.460 -12.993 0.936 118 HB2 GLN 16 HB2 GLN 16 -2.948 -14.424 -1.176 119 HB3 GLN 16 HB1 GLN 16 -2.191 -13.254 -0.139 120 HG2 GLN 16 HG2 GLN 16 -3.648 -15.662 0.773 121 HG3 GLN 16 HG1 GLN 16 -1.926 -15.562 0.638 122 HE21 GLN 16 HE21 GLN 16 -3.529 -16.188 2.921 123 HE22 GLN 16 HE22 GLN 16 -3.189 -15.007 4.133 124 H LYS 17 HN LYS 17 -4.327 -13.017 -2.555 125 HA LYS 17 HA LYS 17 -3.537 -10.285 -2.699 126 HB2 LYS 17 HB2 LYS 17 -4.481 -12.208 -4.824 127 HB3 LYS 17 HB1 LYS 17 -3.721 -10.649 -5.116 128 HG2 LYS 17 HG2 LYS 17 -1.644 -11.367 -4.341 129 HG3 LYS 17 HG1 LYS 17 -2.353 -12.689 -3.415 130 HD2 LYS 17 HD2 LYS 17 -1.137 -13.498 -5.339 131 HD3 LYS 17 HD1 LYS 17 -2.865 -13.860 -5.476 132 HE2 LYS 17 HE2 LYS 17 -3.092 -11.812 -6.884 133 HE3 LYS 17 HE1 LYS 17 -1.325 -11.657 -6.854 134 HZ1 LYS 17 HZ1 LYS 17 -2.285 -12.834 -8.841 135 HZ2 LYS 17 HZ2 LYS 17 -2.741 -14.091 -7.809 136 HZ3 LYS 17 HZ3 LYS 17 -1.110 -13.708 -7.997 137 H ASN 18 HN ASN 18 -6.583 -11.938 -2.616 138 HA ASN 18 HA ASN 18 -8.098 -9.869 -3.898 139 HB2 ASN 18 HB2 ASN 18 -8.734 -12.338 -3.733 140 HB3 ASN 18 HB1 ASN 18 -9.194 -12.005 -2.065 141 HD21 ASN 18 HD21 ASN 18 -11.343 -12.485 -2.455 142 HD22 ASN 18 HD22 ASN 18 -12.372 -11.434 -3.363 143 H GLU 19 HN GLU 19 -7.351 -10.755 -0.561 144 HA GLU 19 HA GLU 19 -8.998 -8.889 0.756 145 HB2 GLU 19 HB2 GLU 19 -7.641 -10.803 1.738 146 HB3 GLU 19 HB1 GLU 19 -6.296 -9.698 1.694 147 HG2 GLU 19 HG2 GLU 19 -7.242 -8.266 3.274 148 HG3 GLU 19 HG1 GLU 19 -8.844 -8.968 3.068 149 H PHE 20 HN PHE 20 -5.661 -8.758 -0.216 150 HA PHE 20 HA PHE 20 -5.125 -6.107 0.505 151 HB2 PHE 20 HB2 PHE 20 -3.828 -7.639 -1.755 152 HB3 PHE 20 HB1 PHE 20 -3.129 -6.332 -0.821 153 HD1 PHE 20 HD1 PHE 20 -1.789 -8.903 -1.230 154 HD2 PHE 20 HD2 PHE 20 -4.465 -7.717 1.837 155 HE1 PHE 20 HE1 PHE 20 -0.792 -10.559 0.257 156 HE2 PHE 20 HE2 PHE 20 -3.474 -9.404 3.340 157 HZ PHE 20 HZ PHE 20 -1.630 -10.834 2.541 158 H LYS 21 HN LYS 21 -6.109 -7.475 -2.633 159 HA LYS 21 HA LYS 21 -6.462 -5.298 -4.213 160 HB2 LYS 21 HB2 LYS 21 -7.132 -7.293 -5.111 161 HB3 LYS 21 HB1 LYS 21 -8.118 -7.699 -3.761 162 HG2 LYS 21 HG2 LYS 21 -9.399 -7.200 -5.805 163 HG3 LYS 21 HG1 LYS 21 -9.801 -6.161 -4.446 164 HD2 LYS 21 HD2 LYS 21 -8.120 -4.516 -5.477 165 HD3 LYS 21 HD1 LYS 21 -8.290 -5.496 -6.941 166 HE2 LYS 21 HE2 LYS 21 -10.807 -4.784 -5.613 167 HE3 LYS 21 HE1 LYS 21 -9.922 -3.423 -6.280 168 HZ1 LYS 21 HZ1 LYS 21 -11.437 -4.292 -7.912 169 HZ2 LYS 21 HZ2 LYS 21 -10.807 -5.851 -7.742 170 HZ3 LYS 21 HZ3 LYS 21 -9.858 -4.626 -8.416 171 H ALA 22 HN ALA 22 -8.744 -6.514 -1.870 172 HA ALA 22 HA ALA 22 -10.743 -4.751 -2.295 173 HB1 ALA 22 HB1 ALA 22 -10.936 -6.675 -0.788 174 HB2 ALA 22 HB2 ALA 22 -11.539 -5.198 -0.032 175 HB3 ALA 22 HB3 ALA 22 -9.951 -5.831 0.408 176 H ALA 23 HN ALA 23 -8.079 -4.341 0.050 177 HA ALA 23 HA ALA 23 -8.718 -1.785 0.956 178 HB1 ALA 23 HB1 ALA 23 -5.964 -2.948 0.519 179 HB2 ALA 23 HB2 ALA 23 -6.950 -3.130 1.965 180 HB3 ALA 23 HB3 ALA 23 -6.348 -1.539 1.505 181 H PHE 24 HN PHE 24 -6.648 -2.677 -1.830 182 HA PHE 24 HA PHE 24 -6.000 -0.220 -2.875 183 HB2 PHE 24 HB2 PHE 24 -5.303 -2.294 -3.938 184 HB3 PHE 24 HB1 PHE 24 -6.933 -2.685 -4.303 185 HD1 PHE 24 HD1 PHE 24 -7.590 -2.473 -6.504 186 HD2 PHE 24 HD2 PHE 24 -4.598 0.142 -4.981 187 HE1 PHE 24 HE1 PHE 24 -7.513 -1.317 -8.660 188 HE2 PHE 24 HE2 PHE 24 -4.484 1.277 -7.149 189 HZ PHE 24 HZ PHE 24 -5.949 0.555 -8.993 190 H ASP 25 HN ASP 25 -8.777 -2.124 -3.495 191 HA ASP 25 HA ASP 25 -10.167 -0.442 -5.228 192 HB2 ASP 25 HB2 ASP 25 -10.563 -2.859 -4.819 193 HB3 ASP 25 HB1 ASP 25 -11.325 -2.426 -3.339 194 H ILE 26 HN ILE 26 -10.647 -0.731 -1.657 195 HA ILE 26 HA ILE 26 -12.663 1.315 -1.648 196 HB ILE 26 HB ILE 26 -10.975 0.404 0.662 197 HG12 ILE 26 HG12 ILE 26 -13.625 -0.657 0.635 198 HG13 ILE 26 HG11 ILE 26 -12.806 -1.029 -0.839 199 HG21 ILE 26 HG21 ILE 26 -12.250 2.480 1.022 200 HG22 ILE 26 HG22 ILE 26 -12.822 1.156 2.045 201 HG23 ILE 26 HG23 ILE 26 -13.720 1.604 0.612 202 HD11 ILE 26 HD11 ILE 26 -12.578 -2.820 0.778 203 HD12 ILE 26 HD12 ILE 26 -11.813 -1.702 1.904 204 HD13 ILE 26 HD13 ILE 26 -11.018 -2.111 0.385 205 H PHE 27 HN PHE 27 -9.212 1.192 -1.273 206 HA PHE 27 HA PHE 27 -8.544 3.707 -0.350 207 HB2 PHE 27 HB2 PHE 27 -7.327 1.595 -1.938 208 HB3 PHE 27 HB1 PHE 27 -6.806 3.182 -2.456 209 HD1 PHE 27 HD1 PHE 27 -6.861 0.842 0.343 210 HD2 PHE 27 HD2 PHE 27 -5.343 4.474 -1.233 211 HE1 PHE 27 HE1 PHE 27 -5.165 0.909 2.123 212 HE2 PHE 27 HE2 PHE 27 -3.673 4.543 0.530 213 HZ PHE 27 HZ PHE 27 -3.571 2.775 2.208 214 H VAL 28 HN VAL 28 -9.877 2.684 -3.358 215 HA VAL 28 HA VAL 28 -9.322 5.313 -4.548 216 HB VAL 28 HB VAL 28 -9.582 4.239 -6.746 217 HG11 VAL 28 HG11 VAL 28 -7.466 3.283 -6.848 218 HG12 VAL 28 HG12 VAL 28 -7.581 2.616 -5.221 219 HG13 VAL 28 HG13 VAL 28 -7.365 4.350 -5.443 220 HG21 VAL 28 HG21 VAL 28 -11.099 2.447 -5.937 221 HG22 VAL 28 HG22 VAL 28 -9.698 1.631 -5.238 222 HG23 VAL 28 HG23 VAL 28 -9.807 1.873 -6.983 223 H LEU 29 HN LEU 29 -11.650 4.616 -2.788 224 HA LEU 29 HA LEU 29 -13.941 4.251 -4.404 225 HB2 LEU 29 HB2 LEU 29 -13.768 5.547 -1.688 226 HB3 LEU 29 HB1 LEU 29 -15.258 5.124 -2.497 227 HG LEU 29 HG LEU 29 -13.163 3.208 -1.501 228 HD11 LEU 29 HD11 LEU 29 -14.348 4.047 0.335 229 HD12 LEU 29 HD12 LEU 29 -15.097 2.488 -0.043 230 HD13 LEU 29 HD13 LEU 29 -15.894 3.989 -0.526 231 HD21 LEU 29 HD21 LEU 29 -14.080 2.228 -3.444 232 HD22 LEU 29 HD22 LEU 29 -15.716 2.723 -3.005 233 HD23 LEU 29 HD23 LEU 29 -14.883 1.488 -2.058 234 H GLY 30 HN GLY 30 -14.776 5.531 -5.845 235 HA2 GLY 30 HA2 GLY 30 -15.649 7.467 -6.776 236 HA3 GLY 30 HA1 GLY 30 -15.039 8.376 -5.407 237 H ALA 31 HN ALA 31 -12.595 6.446 -6.613 238 HA ALA 31 HA ALA 31 -11.128 8.689 -7.611 239 HB1 ALA 31 HB1 ALA 31 -9.948 6.884 -6.512 240 HB2 ALA 31 HB2 ALA 31 -9.392 7.015 -8.183 241 HB3 ALA 31 HB3 ALA 31 -10.515 5.740 -7.724 242 H GLU 32 HN GLU 32 -10.790 9.367 -9.515 243 HA GLU 32 HA GLU 32 -12.571 8.841 -11.609 244 HB2 GLU 32 HB2 GLU 32 -9.891 10.142 -11.969 245 HB3 GLU 32 HB1 GLU 32 -11.404 10.522 -12.777 246 HG2 GLU 32 HG2 GLU 32 -11.302 12.282 -11.344 247 HG3 GLU 32 HG1 GLU 32 -12.134 11.131 -10.303 248 H ASP 33 HN ASP 33 -9.235 7.803 -11.032 249 HA ASP 33 HA ASP 33 -9.305 6.227 -13.495 250 HB2 ASP 33 HB2 ASP 33 -7.389 7.828 -13.067 251 HB3 ASP 33 HB1 ASP 33 -6.912 6.741 -11.778 252 H GLY 34 HN GLY 34 -9.585 5.941 -10.152 253 HA2 GLY 34 HA2 GLY 34 -9.968 4.110 -8.824 254 HA3 GLY 34 HA1 GLY 34 -9.956 3.118 -10.262 255 H SER 35 HN SER 35 -7.197 4.979 -10.073 256 HA SER 35 HA SER 35 -5.692 2.844 -8.741 257 HB2 SER 35 HB2 SER 35 -3.692 4.180 -9.685 258 HB3 SER 35 HB1 SER 35 -4.633 3.231 -10.824 259 HG SER 35 HG SER 35 -5.214 4.985 -11.803 260 H ILE 36 HN ILE 36 -4.130 3.584 -7.130 261 HA ILE 36 HA ILE 36 -5.383 5.546 -5.421 262 HB ILE 36 HB ILE 36 -2.964 3.770 -5.168 263 HG12 ILE 36 HG12 ILE 36 -5.307 3.944 -3.309 264 HG13 ILE 36 HG11 ILE 36 -5.421 3.020 -4.808 265 HG21 ILE 36 HG21 ILE 36 -2.662 4.614 -2.873 266 HG22 ILE 36 HG22 ILE 36 -3.853 5.871 -3.205 267 HG23 ILE 36 HG23 ILE 36 -2.334 5.839 -4.097 268 HD11 ILE 36 HD11 ILE 36 -3.650 1.574 -4.107 269 HD12 ILE 36 HD12 ILE 36 -4.854 1.674 -2.819 270 HD13 ILE 36 HD13 ILE 36 -3.340 2.574 -2.688 271 H SER 37 HN SER 37 -5.125 7.592 -6.064 272 HA SER 37 HA SER 37 -2.549 8.621 -6.886 273 HB2 SER 37 HB2 SER 37 -3.656 10.792 -6.974 274 HB3 SER 37 HB1 SER 37 -4.683 9.596 -7.760 275 HG SER 37 HG SER 37 -6.172 10.027 -6.351 276 H THR 38 HN THR 38 -2.102 10.862 -5.476 277 HA THR 38 HA THR 38 -1.128 9.730 -3.088 278 HB THR 38 HB THR 38 -0.592 12.227 -2.613 279 HG1 THR 38 HG1 THR 38 -0.673 12.562 -5.359 280 HG21 THR 38 HG21 THR 38 1.031 10.479 -3.213 281 HG22 THR 38 HG22 THR 38 1.394 11.975 -4.077 282 HG23 THR 38 HG23 THR 38 0.596 10.643 -4.919 283 H LYS 39 HN LYS 39 -3.765 12.057 -3.653 284 HA LYS 39 HA LYS 39 -4.418 11.991 -0.857 285 HB2 LYS 39 HB2 LYS 39 -4.847 13.984 -2.248 286 HB3 LYS 39 HB1 LYS 39 -6.192 13.095 -2.946 287 HG2 LYS 39 HG2 LYS 39 -7.465 13.495 -1.196 288 HG3 LYS 39 HG1 LYS 39 -6.260 12.875 -0.095 289 HD2 LYS 39 HD2 LYS 39 -6.094 15.648 -1.232 290 HD3 LYS 39 HD1 LYS 39 -7.003 15.297 0.238 291 HE2 LYS 39 HE2 LYS 39 -4.990 14.422 1.306 292 HE3 LYS 39 HE1 LYS 39 -4.072 14.678 -0.180 293 HZ1 LYS 39 HZ1 LYS 39 -5.317 16.789 1.499 294 HZ2 LYS 39 HZ2 LYS 39 -4.543 17.060 0.022 295 HZ3 LYS 39 HZ3 LYS 39 -3.664 16.470 1.336 296 H GLU 40 HN GLU 40 -5.484 10.136 -3.641 297 HA GLU 40 HA GLU 40 -7.616 8.767 -2.407 298 HB2 GLU 40 HB2 GLU 40 -5.635 8.152 -4.529 299 HB3 GLU 40 HB1 GLU 40 -6.311 6.750 -3.718 300 HG2 GLU 40 HG2 GLU 40 -7.505 7.321 -5.761 301 HG3 GLU 40 HG1 GLU 40 -8.533 7.404 -4.346 302 H LEU 41 HN LEU 41 -4.147 8.326 -2.262 303 HA LEU 41 HA LEU 41 -4.070 6.248 -0.349 304 HB2 LEU 41 HB2 LEU 41 -2.251 6.731 -1.869 305 HB3 LEU 41 HB1 LEU 41 -2.070 8.339 -1.195 306 HG LEU 41 HG LEU 41 -1.173 7.465 0.846 307 HD11 LEU 41 HD11 LEU 41 -2.304 5.488 1.267 308 HD12 LEU 41 HD12 LEU 41 -0.683 4.940 0.882 309 HD13 LEU 41 HD13 LEU 41 -1.955 4.830 -0.327 310 HD21 LEU 41 HD21 LEU 41 0.136 6.074 -1.498 311 HD22 LEU 41 HD22 LEU 41 0.922 6.660 -0.032 312 HD23 LEU 41 HD23 LEU 41 0.256 7.804 -1.201 313 H GLY 42 HN GLY 42 -3.878 9.784 -0.115 314 HA2 GLY 42 HA2 GLY 42 -3.306 9.980 2.623 315 HA3 GLY 42 HA1 GLY 42 -3.960 11.252 1.629 316 H LYS 43 HN LYS 43 -6.319 9.681 0.869 317 HA LYS 43 HA LYS 43 -8.240 10.287 2.758 318 HB2 LYS 43 HB2 LYS 43 -8.976 9.620 0.611 319 HB3 LYS 43 HB1 LYS 43 -8.048 8.131 0.661 320 HG2 LYS 43 HG2 LYS 43 -9.667 7.611 2.691 321 HG3 LYS 43 HG1 LYS 43 -10.692 8.765 1.835 322 HD2 LYS 43 HD2 LYS 43 -10.570 7.464 -0.187 323 HD3 LYS 43 HD1 LYS 43 -9.414 6.362 0.544 324 HE2 LYS 43 HE2 LYS 43 -11.772 5.491 0.425 325 HE3 LYS 43 HE1 LYS 43 -11.055 5.480 2.035 326 HZ1 LYS 43 HZ1 LYS 43 -12.273 7.485 2.561 327 HZ2 LYS 43 HZ2 LYS 43 -13.340 6.284 2.035 328 HZ3 LYS 43 HZ3 LYS 43 -12.915 7.546 0.999 329 H VAL 44 HN VAL 44 -6.490 7.274 2.302 330 HA VAL 44 HA VAL 44 -7.766 5.959 4.480 331 HB VAL 44 HB VAL 44 -5.251 5.177 3.047 332 HG11 VAL 44 HG11 VAL 44 -5.824 2.901 3.733 333 HG12 VAL 44 HG12 VAL 44 -7.289 3.483 4.522 334 HG13 VAL 44 HG13 VAL 44 -5.708 3.938 5.160 335 HG21 VAL 44 HG21 VAL 44 -6.871 5.571 1.374 336 HG22 VAL 44 HG22 VAL 44 -8.150 4.875 2.357 337 HG23 VAL 44 HG23 VAL 44 -6.904 3.840 1.659 338 H MET 45 HN MET 45 -4.604 7.469 3.977 339 HA MET 45 HA MET 45 -3.407 6.942 6.440 340 HB2 MET 45 HB2 MET 45 -3.353 9.525 4.873 341 HB3 MET 45 HB1 MET 45 -2.204 9.044 6.104 342 HG2 MET 45 HG2 MET 45 -2.607 7.284 3.796 343 HG3 MET 45 HG1 MET 45 -1.708 8.748 3.585 344 HE1 MET 45 HE1 MET 45 -0.126 9.226 6.173 345 HE2 MET 45 HE2 MET 45 0.483 9.319 4.520 346 HE3 MET 45 HE3 MET 45 1.364 8.391 5.737 347 H ARG 46 HN ARG 46 -5.614 9.626 5.511 348 HA ARG 46 HA ARG 46 -5.720 10.774 8.071 349 HB2 ARG 46 HB2 ARG 46 -7.132 11.068 5.514 350 HB3 ARG 46 HB1 ARG 46 -7.973 11.644 6.920 351 HG2 ARG 46 HG2 ARG 46 -6.718 13.462 7.024 352 HG3 ARG 46 HG1 ARG 46 -5.257 12.476 7.037 353 HD2 ARG 46 HD2 ARG 46 -4.932 13.575 5.133 354 HD3 ARG 46 HD1 ARG 46 -5.828 12.224 4.487 355 HE ARG 46 HE ARG 46 -6.984 14.876 5.048 356 HH11 ARG 46 HH11 ARG 46 -6.891 11.910 3.198 357 HH12 ARG 46 HH12 ARG 46 -8.120 12.417 2.085 358 HH21 ARG 46 HH21 ARG 46 -8.580 15.556 3.578 359 HH22 ARG 46 HH22 ARG 46 -9.079 14.492 2.298 360 H MET 47 HN MET 47 -7.563 8.251 6.504 361 HA MET 47 HA MET 47 -9.570 7.841 8.374 362 HB2 MET 47 HB2 MET 47 -8.109 6.218 6.358 363 HB3 MET 47 HB1 MET 47 -9.313 5.482 7.348 364 HG2 MET 47 HG2 MET 47 -11.028 6.819 6.466 365 HG3 MET 47 HG1 MET 47 -9.867 7.912 5.731 366 HE1 MET 47 HE1 MET 47 -10.637 3.618 4.255 367 HE2 MET 47 HE2 MET 47 -11.734 4.423 5.377 368 HE3 MET 47 HE3 MET 47 -10.085 4.044 5.873 369 H LEU 48 HN LEU 48 -6.186 7.246 8.461 370 HA LEU 48 HA LEU 48 -6.348 5.368 10.693 371 HB2 LEU 48 HB2 LEU 48 -3.945 6.415 9.280 372 HB3 LEU 48 HB1 LEU 48 -3.976 5.077 10.383 373 HG LEU 48 HG LEU 48 -5.019 5.203 7.584 374 HD11 LEU 48 HD11 LEU 48 -3.558 3.339 7.241 375 HD12 LEU 48 HD12 LEU 48 -3.176 3.263 8.960 376 HD13 LEU 48 HD13 LEU 48 -2.652 4.652 8.004 377 HD21 LEU 48 HD21 LEU 48 -5.590 3.040 9.608 378 HD22 LEU 48 HD22 LEU 48 -6.018 3.019 7.901 379 HD23 LEU 48 HD23 LEU 48 -6.772 4.191 8.975 380 H GLY 49 HN GLY 49 -6.377 8.625 10.323 381 HA2 GLY 49 HA2 GLY 49 -6.217 10.154 12.124 382 HA3 GLY 49 HA1 GLY 49 -5.114 9.047 12.929 383 H GLN 50 HN GLN 50 -4.115 9.167 9.802 384 HA GLN 50 HA GLN 50 -1.931 10.978 10.350 385 HB2 GLN 50 HB2 GLN 50 -2.726 9.613 7.778 386 HB3 GLN 50 HB1 GLN 50 -1.185 10.389 8.075 387 HG2 GLN 50 HG2 GLN 50 -2.254 7.926 9.456 388 HG3 GLN 50 HG1 GLN 50 -1.047 7.938 8.176 389 HE21 GLN 50 HE21 GLN 50 -1.702 8.586 11.519 390 HE22 GLN 50 HE22 GLN 50 -0.055 8.714 12.025 391 H ASN 51 HN ASN 51 -1.446 12.798 8.851 392 HA ASN 51 HA ASN 51 -3.566 13.486 6.998 393 HB2 ASN 51 HB2 ASN 51 -4.091 14.791 9.028 394 HB3 ASN 51 HB1 ASN 51 -2.518 15.540 8.869 395 HD21 ASN 51 HD21 ASN 51 -3.444 17.594 8.609 396 HD22 ASN 51 HD22 ASN 51 -4.198 18.053 7.124 397 HA PRO 52 HA PRO 52 0.816 13.500 5.353 398 HB2 PRO 52 HB2 PRO 52 -0.282 12.563 2.971 399 HB3 PRO 52 HB1 PRO 52 0.604 11.636 4.149 400 HG2 PRO 52 HG2 PRO 52 -2.282 11.777 3.627 401 HG3 PRO 52 HG1 PRO 52 -1.340 10.476 4.357 402 HD2 PRO 52 HD2 PRO 52 -2.965 12.098 5.800 403 HD3 PRO 52 HD1 PRO 52 -1.516 11.339 6.445 404 H THR 53 HN THR 53 1.661 14.711 3.758 405 HA THR 53 HA THR 53 -0.222 16.105 2.022 406 HB THR 53 HB THR 53 1.770 17.548 1.409 407 HG1 THR 53 HG1 THR 53 2.887 15.982 3.505 408 HG21 THR 53 HG21 THR 53 1.678 18.911 3.444 409 HG22 THR 53 HG22 THR 53 0.929 17.568 4.309 410 HG23 THR 53 HG23 THR 53 0.075 18.346 2.977 411 HA PRO 54 HA PRO 54 0.420 13.497 -1.325 412 HB2 PRO 54 HB2 PRO 54 1.104 15.954 -2.817 413 HB3 PRO 54 HB1 PRO 54 0.026 14.635 -3.271 414 HG2 PRO 54 HG2 PRO 54 -0.995 16.830 -2.330 415 HG3 PRO 54 HG1 PRO 54 -1.575 15.288 -1.726 416 HD2 PRO 54 HD2 PRO 54 0.250 17.258 -0.435 417 HD3 PRO 54 HD1 PRO 54 -1.049 16.283 0.286 418 H GLU 55 HN GLU 55 3.002 15.752 -0.651 419 HA GLU 55 HA GLU 55 4.998 14.704 -2.297 420 HB2 GLU 55 HB2 GLU 55 5.088 16.022 0.377 421 HB3 GLU 55 HB1 GLU 55 6.494 15.734 -0.570 422 HG2 GLU 55 HG2 GLU 55 5.574 17.086 -2.295 423 HG3 GLU 55 HG1 GLU 55 4.152 17.330 -1.347 424 H GLU 56 HN GLU 56 4.425 14.134 1.136 425 HA GLU 56 HA GLU 56 6.062 12.001 1.662 426 HB2 GLU 56 HB2 GLU 56 3.230 12.461 2.619 427 HB3 GLU 56 HB1 GLU 56 4.497 11.660 3.493 428 HG2 GLU 56 HG2 GLU 56 5.773 13.797 3.493 429 HG3 GLU 56 HG1 GLU 56 4.392 14.520 2.734 430 H LEU 57 HN LEU 57 2.673 11.919 0.979 431 HA LEU 57 HA LEU 57 2.130 9.290 0.542 432 HB2 LEU 57 HB2 LEU 57 0.985 11.679 -0.833 433 HB3 LEU 57 HB1 LEU 57 0.270 10.077 -0.912 434 HG LEU 57 HG LEU 57 0.787 11.393 1.726 435 HD11 LEU 57 HD11 LEU 57 -1.489 11.898 -0.168 436 HD12 LEU 57 HD12 LEU 57 -0.503 13.065 0.723 437 HD13 LEU 57 HD13 LEU 57 -1.678 12.061 1.581 438 HD21 LEU 57 HD21 LEU 57 -1.117 9.972 2.388 439 HD22 LEU 57 HD22 LEU 57 0.248 9.043 1.784 440 HD23 LEU 57 HD23 LEU 57 -1.166 9.315 0.765 441 H GLN 58 HN GLN 58 3.453 11.532 -1.811 442 HA GLN 58 HA GLN 58 3.151 9.974 -4.102 443 HB2 GLN 58 HB2 GLN 58 3.807 12.374 -4.082 444 HB3 GLN 58 HB1 GLN 58 5.395 11.900 -3.497 445 HG2 GLN 58 HG2 GLN 58 5.820 10.680 -5.546 446 HG3 GLN 58 HG1 GLN 58 4.200 11.067 -6.136 447 HE21 GLN 58 HE21 GLN 58 4.959 12.178 -7.930 448 HE22 GLN 58 HE22 GLN 58 5.730 13.721 -7.806 449 H GLU 59 HN GLU 59 5.800 10.102 -1.746 450 HA GLU 59 HA GLU 59 7.554 8.401 -3.087 451 HB2 GLU 59 HB2 GLU 59 7.262 8.740 -0.166 452 HB3 GLU 59 HB1 GLU 59 8.711 8.246 -0.998 453 HG2 GLU 59 HG2 GLU 59 7.359 10.918 -1.245 454 HG3 GLU 59 HG1 GLU 59 8.792 10.576 -0.290 455 H MET 60 HN MET 60 4.921 7.698 -0.854 456 HA MET 60 HA MET 60 5.466 4.958 -0.477 457 HB2 MET 60 HB2 MET 60 2.674 5.896 -0.528 458 HB3 MET 60 HB1 MET 60 3.432 4.781 0.574 459 HG2 MET 60 HG2 MET 60 4.747 7.010 1.235 460 HG3 MET 60 HG1 MET 60 3.237 7.721 0.702 461 HE1 MET 60 HE1 MET 60 1.206 5.481 1.404 462 HE2 MET 60 HE2 MET 60 0.830 7.128 1.910 463 HE3 MET 60 HE3 MET 60 0.710 5.791 3.068 464 H ILE 61 HN ILE 61 3.687 6.743 -2.847 465 HA ILE 61 HA ILE 61 2.710 4.524 -4.345 466 HB ILE 61 HB ILE 61 2.998 7.450 -4.945 467 HG12 ILE 61 HG12 ILE 61 0.831 5.631 -3.956 468 HG13 ILE 61 HG11 ILE 61 1.436 7.122 -3.245 469 HG21 ILE 61 HG21 ILE 61 3.041 6.113 -7.044 470 HG22 ILE 61 HG22 ILE 61 1.630 7.169 -6.885 471 HG23 ILE 61 HG23 ILE 61 1.477 5.440 -6.585 472 HD11 ILE 61 HD11 ILE 61 0.435 8.364 -5.091 473 HD12 ILE 61 HD12 ILE 61 -0.748 7.455 -4.150 474 HD13 ILE 61 HD13 ILE 61 -0.209 6.846 -5.716 475 H ASP 62 HN ASP 62 5.347 6.855 -4.751 476 HA ASP 62 HA ASP 62 6.307 6.104 -7.238 477 HB2 ASP 62 HB2 ASP 62 6.970 8.128 -5.887 478 HB3 ASP 62 HB1 ASP 62 8.002 7.068 -4.938 479 H GLU 63 HN GLU 63 7.160 4.866 -4.063 480 HA GLU 63 HA GLU 63 9.260 3.205 -4.558 481 HB2 GLU 63 HB2 GLU 63 8.128 3.611 -2.393 482 HB3 GLU 63 HB1 GLU 63 6.898 2.471 -2.901 483 HG2 GLU 63 HG2 GLU 63 8.533 1.428 -1.468 484 HG3 GLU 63 HG1 GLU 63 8.535 0.715 -3.069 485 H VAL 64 HN VAL 64 5.826 2.382 -5.033 486 HA VAL 64 HA VAL 64 6.601 -0.165 -6.237 487 HB VAL 64 HB VAL 64 4.267 -0.800 -6.169 488 HG11 VAL 64 HG11 VAL 64 3.981 -0.823 -3.733 489 HG12 VAL 64 HG12 VAL 64 5.361 0.270 -3.579 490 HG13 VAL 64 HG13 VAL 64 5.572 -1.347 -4.277 491 HG21 VAL 64 HG21 VAL 64 2.568 0.597 -5.152 492 HG22 VAL 64 HG22 VAL 64 3.293 1.416 -6.537 493 HG23 VAL 64 HG23 VAL 64 3.749 1.884 -4.891 494 H ASP 65 HN ASP 65 5.528 2.918 -7.129 495 HA ASP 65 HA ASP 65 4.049 2.335 -9.441 496 HB2 ASP 65 HB2 ASP 65 4.096 4.498 -8.172 497 HB3 ASP 65 HB1 ASP 65 5.682 4.811 -8.864 498 H GLU 66 HN GLU 66 4.871 1.116 -11.024 499 HA GLU 66 HA GLU 66 7.626 1.071 -11.692 500 HB2 GLU 66 HB2 GLU 66 5.245 -0.097 -13.103 501 HB3 GLU 66 HB1 GLU 66 6.902 -0.501 -13.386 502 HG2 GLU 66 HG2 GLU 66 7.101 -1.394 -11.137 503 HG3 GLU 66 HG1 GLU 66 5.412 -0.999 -10.879 504 H ASP 67 HN ASP 67 4.857 2.840 -12.807 505 HA ASP 67 HA ASP 67 6.170 3.473 -15.361 506 HB2 ASP 67 HB2 ASP 67 3.835 2.626 -15.397 507 HB3 ASP 67 HB1 ASP 67 3.336 4.027 -14.464 508 H GLY 68 HN GLY 68 5.882 4.700 -12.308 509 HA2 GLY 68 HA2 GLY 68 6.224 6.753 -11.343 510 HA3 GLY 68 HA1 GLY 68 6.934 7.259 -12.872 511 H SER 69 HN SER 69 3.677 6.100 -12.286 512 HA SER 69 HA SER 69 2.624 8.263 -13.877 513 HB2 SER 69 HB2 SER 69 1.887 5.862 -14.064 514 HB3 SER 69 HB1 SER 69 1.133 6.030 -12.482 515 HG SER 69 HG SER 69 -0.502 6.931 -13.423 516 H GLY 70 HN GLY 70 2.980 7.553 -10.527 517 HA2 GLY 70 HA2 GLY 70 2.564 9.059 -8.760 518 HA3 GLY 70 HA1 GLY 70 1.539 10.003 -9.835 519 H THR 71 HN THR 71 0.963 6.704 -10.033 520 HA THR 71 HA THR 71 -1.101 6.700 -7.981 521 HB THR 71 HB THR 71 -2.708 5.666 -9.626 522 HG1 THR 71 HG1 THR 71 -1.130 5.345 -11.292 523 HG21 THR 71 HG21 THR 71 -3.522 7.814 -10.515 524 HG22 THR 71 HG22 THR 71 -1.998 8.572 -10.043 525 HG23 THR 71 HG23 THR 71 -3.081 7.925 -8.809 526 H VAL 72 HN VAL 72 -1.406 4.737 -7.148 527 HA VAL 72 HA VAL 72 0.087 2.472 -8.197 528 HB VAL 72 HB VAL 72 -1.406 3.032 -5.666 529 HG11 VAL 72 HG11 VAL 72 -1.097 0.796 -4.920 530 HG12 VAL 72 HG12 VAL 72 -0.055 0.392 -6.291 531 HG13 VAL 72 HG13 VAL 72 -1.794 0.661 -6.527 532 HG21 VAL 72 HG21 VAL 72 0.824 3.958 -5.882 533 HG22 VAL 72 HG22 VAL 72 1.473 2.367 -6.266 534 HG23 VAL 72 HG23 VAL 72 0.796 2.683 -4.687 535 H ASP 73 HN ASP 73 -0.785 0.838 -9.241 536 HA ASP 73 HA ASP 73 -3.728 0.563 -9.157 537 HB2 ASP 73 HB2 ASP 73 -2.846 0.969 -11.442 538 HB3 ASP 73 HB1 ASP 73 -1.805 -0.433 -11.285 539 H PHE 74 HN PHE 74 -3.929 -2.193 -9.837 540 HA PHE 74 HA PHE 74 -4.047 -2.867 -7.146 541 HB2 PHE 74 HB2 PHE 74 -5.612 -3.862 -8.576 542 HB3 PHE 74 HB1 PHE 74 -4.390 -4.542 -9.597 543 HD1 PHE 74 HD1 PHE 74 -4.518 -4.650 -5.893 544 HD2 PHE 74 HD2 PHE 74 -4.918 -6.830 -9.537 545 HE1 PHE 74 HE1 PHE 74 -4.659 -6.747 -4.630 546 HE2 PHE 74 HE2 PHE 74 -5.067 -8.929 -8.263 547 HZ PHE 74 HZ PHE 74 -4.939 -8.884 -5.806 548 H ASP 75 HN ASP 75 -1.820 -4.529 -9.495 549 HA ASP 75 HA ASP 75 -0.616 -5.990 -7.438 550 HB2 ASP 75 HB2 ASP 75 -0.376 -6.899 -9.540 551 HB3 ASP 75 HB1 ASP 75 0.236 -5.424 -10.199 552 H GLU 76 HN GLU 76 -0.000 -2.775 -8.582 553 HA GLU 76 HA GLU 76 2.508 -2.382 -7.399 554 HB2 GLU 76 HB2 GLU 76 0.362 -0.387 -7.798 555 HB3 GLU 76 HB1 GLU 76 2.018 -0.023 -7.485 556 HG2 GLU 76 HG2 GLU 76 2.608 -1.235 -9.513 557 HG3 GLU 76 HG1 GLU 76 0.915 -1.383 -9.886 558 H PHE 77 HN PHE 77 -0.704 -1.606 -6.279 559 HA PHE 77 HA PHE 77 -0.168 -0.932 -3.636 560 HB2 PHE 77 HB2 PHE 77 -2.437 -0.776 -4.725 561 HB3 PHE 77 HB1 PHE 77 -2.572 -2.535 -4.594 562 HD1 PHE 77 HD1 PHE 77 -2.065 0.529 -2.584 563 HD2 PHE 77 HD2 PHE 77 -3.459 -3.495 -2.629 564 HE1 PHE 77 HE1 PHE 77 -2.918 0.810 -0.303 565 HE2 PHE 77 HE2 PHE 77 -4.314 -3.217 -0.326 566 HZ PHE 77 HZ PHE 77 -4.044 -1.052 0.836 567 H LEU 78 HN LEU 78 -0.920 -4.001 -5.084 568 HA LEU 78 HA LEU 78 -1.214 -5.545 -2.839 569 HB2 LEU 78 HB2 LEU 78 -1.900 -6.170 -5.059 570 HB3 LEU 78 HB1 LEU 78 -0.236 -6.243 -5.560 571 HG LEU 78 HG LEU 78 0.093 -8.319 -4.695 572 HD11 LEU 78 HD11 LEU 78 -2.091 -7.807 -2.733 573 HD12 LEU 78 HD12 LEU 78 -0.358 -7.756 -2.394 574 HD13 LEU 78 HD13 LEU 78 -1.128 -9.276 -2.864 575 HD21 LEU 78 HD21 LEU 78 -1.836 -9.690 -5.003 576 HD22 LEU 78 HD22 LEU 78 -1.775 -8.460 -6.264 577 HD23 LEU 78 HD23 LEU 78 -2.883 -8.281 -4.893 578 H VAL 79 HN VAL 79 1.798 -4.995 -4.670 579 HA VAL 79 HA VAL 79 3.116 -6.918 -3.070 580 HB VAL 79 HB VAL 79 3.803 -5.646 -5.424 581 HG11 VAL 79 HG11 VAL 79 4.943 -3.806 -4.288 582 HG12 VAL 79 HG12 VAL 79 6.145 -4.906 -4.956 583 HG13 VAL 79 HG13 VAL 79 5.778 -4.947 -3.238 584 HG21 VAL 79 HG21 VAL 79 4.778 -7.692 -3.608 585 HG22 VAL 79 HG22 VAL 79 5.916 -7.109 -4.821 586 HG23 VAL 79 HG23 VAL 79 4.338 -7.754 -5.310 587 H MET 80 HN MET 80 2.947 -3.371 -2.985 588 HA MET 80 HA MET 80 4.797 -3.123 -0.848 589 HB2 MET 80 HB2 MET 80 4.330 -1.161 -2.070 590 HB3 MET 80 HB1 MET 80 2.597 -1.338 -1.858 591 HG2 MET 80 HG2 MET 80 3.430 0.451 -0.490 592 HG3 MET 80 HG1 MET 80 2.864 -0.868 0.529 593 HE1 MET 80 HE1 MET 80 6.231 -0.479 -1.486 594 HE2 MET 80 HE2 MET 80 7.277 0.201 -0.239 595 HE3 MET 80 HE3 MET 80 5.893 1.125 -0.831 596 H MET 81 HN MET 81 1.397 -3.813 -1.077 597 HA MET 81 HA MET 81 0.737 -3.769 1.620 598 HB2 MET 81 HB2 MET 81 -0.875 -4.039 -0.130 599 HB3 MET 81 HB1 MET 81 -0.196 -5.566 -0.619 600 HG2 MET 81 HG2 MET 81 -2.325 -5.637 0.665 601 HG3 MET 81 HG1 MET 81 -1.015 -6.623 1.292 602 HE1 MET 81 HE1 MET 81 -1.933 -2.492 3.078 603 HE2 MET 81 HE2 MET 81 -2.391 -3.019 1.463 604 HE3 MET 81 HE3 MET 81 -0.692 -2.741 1.855 605 H VAL 82 HN VAL 82 1.820 -6.607 -0.279 606 HA VAL 82 HA VAL 82 2.160 -8.246 2.010 607 HB VAL 82 HB VAL 82 2.026 -9.156 -0.325 608 HG11 VAL 82 HG11 VAL 82 3.908 -9.195 -1.759 609 HG12 VAL 82 HG12 VAL 82 4.950 -8.507 -0.512 610 HG13 VAL 82 HG13 VAL 82 3.699 -7.510 -1.256 611 HG21 VAL 82 HG21 VAL 82 2.733 -10.572 1.528 612 HG22 VAL 82 HG22 VAL 82 4.400 -10.029 1.324 613 HG23 VAL 82 HG23 VAL 82 3.623 -10.984 0.063 614 H ARG 83 HN ARG 83 4.121 -5.810 0.566 615 HA ARG 83 HA ARG 83 6.540 -6.451 1.932 616 HB2 ARG 83 HB2 ARG 83 6.354 -5.080 -0.163 617 HB3 ARG 83 HB1 ARG 83 5.693 -3.803 0.832 618 HG2 ARG 83 HG2 ARG 83 7.789 -3.882 2.189 619 HG3 ARG 83 HG1 ARG 83 8.426 -4.977 0.967 620 HD2 ARG 83 HD2 ARG 83 8.587 -3.351 -0.624 621 HD3 ARG 83 HD1 ARG 83 7.279 -2.394 0.066 622 HE ARG 83 HE ARG 83 9.278 -2.325 1.941 623 HH11 ARG 83 HH11 ARG 83 9.148 -1.543 -1.467 624 HH12 ARG 83 HH12 ARG 83 10.228 -0.195 -1.331 625 HH21 ARG 83 HH21 ARG 83 10.690 -0.560 2.133 626 HH22 ARG 83 HH22 ARG 83 11.125 0.358 0.727 627 H SER 84 HN SER 84 3.933 -4.086 2.462 628 HA SER 84 HA SER 84 5.092 -2.827 4.696 629 HB2 SER 84 HB2 SER 84 3.257 -1.825 3.309 630 HB3 SER 84 HB1 SER 84 2.126 -2.972 4.021 631 HG SER 84 HG SER 84 2.152 -0.921 5.089 632 H MET 85 HN MET 85 2.859 -5.548 4.416 633 HA MET 85 HA MET 85 2.459 -5.806 7.230 634 HB2 MET 85 HB2 MET 85 1.396 -7.916 6.710 635 HB3 MET 85 HB1 MET 85 0.865 -6.693 5.567 636 HG2 MET 85 HG2 MET 85 2.599 -7.560 4.008 637 HG3 MET 85 HG1 MET 85 2.851 -8.889 5.124 638 HE1 MET 85 HE1 MET 85 -0.481 -7.057 4.239 639 HE2 MET 85 HE2 MET 85 -1.098 -8.056 2.928 640 HE3 MET 85 HE3 MET 85 0.374 -7.111 2.696 641 H LYS 86 HN LYS 86 4.926 -6.751 5.044 642 HA LYS 86 HA LYS 86 5.898 -8.885 6.687 643 HB2 LYS 86 HB2 LYS 86 5.942 -9.000 4.236 644 HB3 LYS 86 HB1 LYS 86 7.047 -7.644 4.240 645 HG2 LYS 86 HG2 LYS 86 8.401 -9.516 4.029 646 HG3 LYS 86 HG1 LYS 86 8.525 -9.000 5.702 647 HD2 LYS 86 HD2 LYS 86 8.312 -11.422 5.517 648 HD3 LYS 86 HD1 LYS 86 6.966 -10.703 6.390 649 HE2 LYS 86 HE2 LYS 86 5.526 -10.938 4.492 650 HE3 LYS 86 HE1 LYS 86 6.875 -11.432 3.469 651 HZ1 LYS 86 HZ1 LYS 86 5.821 -12.945 5.798 652 HZ2 LYS 86 HZ2 LYS 86 7.107 -13.429 4.810 653 HZ3 LYS 86 HZ3 LYS 86 5.549 -13.321 4.174 654 H ASP 87 HN ASP 87 7.016 -5.709 5.576 655 HA ASP 87 HA ASP 87 9.401 -5.819 7.175 656 HB2 ASP 87 HB2 ASP 87 8.140 -3.484 5.729 657 HB3 ASP 87 HB1 ASP 87 9.727 -3.466 6.476 658 H ASP 88 HN ASP 88 6.269 -5.365 8.017 659 HA ASP 88 HA ASP 88 6.137 -3.026 9.500 660 HB2 ASP 88 HB2 ASP 88 4.195 -4.459 9.010 661 HB3 ASP 88 HB1 ASP 88 4.815 -5.670 10.123 662 H SER 89 HN SER 89 6.751 -6.287 10.787 663 HA SER 89 HA SER 89 8.502 -5.079 12.795 664 HB2 SER 89 HB2 SER 89 6.289 -7.052 13.427 665 HB3 SER 89 HB1 SER 89 7.472 -6.435 14.577 666 HG SER 89 HG SER 89 5.478 -4.954 13.183 667 H LYS 90 HN LYS 90 10.380 -5.964 12.395 668 HA LYS 90 HA LYS 90 10.580 -8.882 12.272 669 HB2 LYS 90 HB2 LYS 90 10.656 -8.031 9.947 670 HB3 LYS 90 HB1 LYS 90 12.004 -7.003 10.388 671 HG2 LYS 90 HG2 LYS 90 12.636 -9.047 9.169 672 HG3 LYS 90 HG1 LYS 90 13.414 -8.889 10.742 673 HD2 LYS 90 HD2 LYS 90 11.975 -10.520 11.705 674 HD3 LYS 90 HD1 LYS 90 10.920 -10.517 10.290 675 HE2 LYS 90 HE2 LYS 90 12.370 -12.497 10.357 676 HE3 LYS 90 HE1 LYS 90 12.681 -11.498 8.940 677 HZ1 LYS 90 HZ1 LYS 90 14.722 -12.291 10.002 678 HZ2 LYS 90 HZ2 LYS 90 14.315 -11.475 11.424 679 HZ3 LYS 90 HZ3 LYS 90 14.631 -10.604 10.011 680 H GLY 136 HN GLY 136 11.174 -8.555 14.488 681 HA2 GLY 136 HA2 GLY 136 12.935 -8.617 16.037 682 HA3 GLY 136 HA1 GLY 136 13.991 -7.883 14.837 683 H LYS 137 HN LYS 137 11.935 -5.859 14.249 684 HA LYS 137 HA LYS 137 11.597 -4.300 16.643 685 HB2 LYS 137 HB2 LYS 137 12.733 -2.323 15.316 686 HB3 LYS 137 HB1 LYS 137 13.671 -3.358 16.389 687 HG2 LYS 137 HG2 LYS 137 14.931 -3.074 14.391 688 HG3 LYS 137 HG1 LYS 137 14.301 -4.718 14.376 689 HD2 LYS 137 HD2 LYS 137 12.448 -3.929 12.907 690 HD3 LYS 137 HD1 LYS 137 13.236 -2.348 12.840 691 HE2 LYS 137 HE2 LYS 137 14.374 -4.973 11.893 692 HE3 LYS 137 HE1 LYS 137 13.819 -3.645 10.880 693 HZ1 LYS 137 HZ1 LYS 137 15.582 -2.265 11.773 694 HZ2 LYS 137 HZ2 LYS 137 16.226 -3.675 11.092 695 HZ3 LYS 137 HZ3 LYS 137 16.108 -3.526 12.772 696 H PHE 138 HN PHE 138 11.090 -1.875 15.571 697 HA PHE 138 HA PHE 138 9.176 -2.318 13.412 698 HB2 PHE 138 HB2 PHE 138 7.972 -2.579 15.526 699 HB3 PHE 138 HB1 PHE 138 8.542 -1.006 16.059 700 HD1 PHE 138 HD1 PHE 138 7.304 -1.950 12.712 701 HD2 PHE 138 HD2 PHE 138 6.572 0.205 16.293 702 HE1 PHE 138 HE1 PHE 138 5.352 -0.882 11.658 703 HE2 PHE 138 HE2 PHE 138 4.616 1.283 15.255 704 HZ PHE 138 HZ PHE 138 4.006 0.740 12.933 705 H LYS 139 HN LYS 139 10.960 -1.197 12.308 706 HA LYS 139 HA LYS 139 10.341 1.514 11.897 707 HB2 LYS 139 HB2 LYS 139 12.482 0.984 13.822 708 HB3 LYS 139 HB1 LYS 139 12.980 2.029 12.498 709 HG2 LYS 139 HG2 LYS 139 10.580 2.494 14.257 710 HG3 LYS 139 HG1 LYS 139 12.148 3.277 14.455 711 HD2 LYS 139 HD2 LYS 139 11.934 4.395 12.354 712 HD3 LYS 139 HD1 LYS 139 10.507 3.451 11.930 713 HE2 LYS 139 HE2 LYS 139 9.935 5.728 12.642 714 HE3 LYS 139 HE1 LYS 139 9.240 4.507 13.703 715 HZ1 LYS 139 HZ1 LYS 139 11.011 4.921 15.285 716 HZ2 LYS 139 HZ2 LYS 139 10.187 6.355 14.943 717 HZ3 LYS 139 HZ3 LYS 139 11.702 6.070 14.259 718 H ARG 140 HN ARG 140 10.170 0.201 9.935 719 HA ARG 140 HA ARG 140 12.643 -0.333 8.538 720 HB2 ARG 140 HB2 ARG 140 11.067 -0.784 6.591 721 HB3 ARG 140 HB1 ARG 140 10.938 -1.851 7.977 722 HG2 ARG 140 HG2 ARG 140 8.750 -1.419 7.960 723 HG3 ARG 140 HG1 ARG 140 9.161 0.199 8.533 724 HD2 ARG 140 HD2 ARG 140 7.802 0.533 6.641 725 HD3 ARG 140 HD1 ARG 140 9.450 0.836 6.088 726 HE ARG 140 HE ARG 140 9.120 -1.765 5.515 727 HH11 ARG 140 HH11 ARG 140 7.264 1.096 4.761 728 HH12 ARG 140 HH12 ARG 140 6.499 0.392 3.375 729 HH21 ARG 140 HH21 ARG 140 8.122 -2.712 3.701 730 HH22 ARG 140 HH22 ARG 140 6.982 -1.775 2.775 731 HA PRO 141 HA PRO 141 13.029 3.672 6.937 732 HB2 PRO 141 HB2 PRO 141 14.991 2.594 5.076 733 HB3 PRO 141 HB1 PRO 141 15.273 3.471 6.580 734 HG2 PRO 141 HG2 PRO 141 15.906 0.851 6.343 735 HG3 PRO 141 HG1 PRO 141 15.328 1.541 7.861 736 HD2 PRO 141 HD2 PRO 141 13.759 0.159 5.709 737 HD3 PRO 141 HD1 PRO 141 13.854 -0.227 7.429 738 H THR 142 HN THR 142 11.667 4.626 5.583 739 HA THR 142 HA THR 142 11.663 3.876 2.787 740 HB THR 142 HB THR 142 9.007 4.104 4.211 741 HG1 THR 142 HG1 THR 142 10.725 1.930 3.889 742 HG21 THR 142 HG21 THR 142 8.203 2.954 2.153 743 HG22 THR 142 HG22 THR 142 9.821 3.123 1.476 744 HG23 THR 142 HG23 THR 142 8.866 4.559 1.849 745 H LEU 143 HN LEU 143 10.537 5.900 5.375 746 HA LEU 143 HA LEU 143 11.095 8.390 4.392 747 HB2 LEU 143 HB2 LEU 143 9.597 7.711 2.514 748 HB3 LEU 143 HB1 LEU 143 8.290 7.532 3.663 749 HG LEU 143 HG LEU 143 8.876 10.062 4.194 750 HD11 LEU 143 HD11 LEU 143 10.752 10.218 2.678 751 HD12 LEU 143 HD12 LEU 143 9.426 11.257 2.138 752 HD13 LEU 143 HD13 LEU 143 9.725 9.711 1.336 753 HD21 LEU 143 HD21 LEU 143 6.718 9.254 3.483 754 HD22 LEU 143 HD22 LEU 143 7.293 9.125 1.816 755 HD23 LEU 143 HD23 LEU 143 7.157 10.708 2.592 756 H ARG 144 HN ARG 144 11.351 8.689 6.673 757 HA ARG 144 HA ARG 144 9.189 7.961 8.425 758 HB2 ARG 144 HB2 ARG 144 10.628 8.942 10.217 759 HB3 ARG 144 HB1 ARG 144 11.386 7.657 9.291 760 HG2 ARG 144 HG2 ARG 144 12.780 9.169 8.143 761 HG3 ARG 144 HG1 ARG 144 11.844 10.563 8.687 762 HD2 ARG 144 HD2 ARG 144 13.521 8.744 10.414 763 HD3 ARG 144 HD1 ARG 144 13.920 10.395 9.942 764 HE ARG 144 HE ARG 144 11.549 10.704 11.176 765 HH11 ARG 144 HH11 ARG 144 14.503 9.083 12.158 766 HH12 ARG 144 HH12 ARG 144 14.222 9.337 13.849 767 HH21 ARG 144 HH21 ARG 144 11.186 11.036 13.390 768 HH22 ARG 144 HH22 ARG 144 12.338 10.452 14.550 769 H ARG 145 HN ARG 145 7.694 9.306 7.249 770 HA ARG 145 HA ARG 145 7.563 12.041 8.341 771 HB2 ARG 145 HB2 ARG 145 6.496 10.861 5.776 772 HB3 ARG 145 HB1 ARG 145 6.029 12.447 6.374 773 HG2 ARG 145 HG2 ARG 145 8.911 12.025 6.229 774 HG3 ARG 145 HG1 ARG 145 8.083 11.966 4.670 775 HD2 ARG 145 HD2 ARG 145 7.104 14.107 5.061 776 HD3 ARG 145 HD1 ARG 145 7.770 14.161 6.691 777 HE ARG 145 HE ARG 145 9.856 13.837 4.823 778 HH11 ARG 145 HH11 ARG 145 7.574 16.259 5.912 779 HH12 ARG 145 HH12 ARG 145 8.597 17.596 5.498 780 HH21 ARG 145 HH21 ARG 145 11.217 15.607 4.288 781 HH22 ARG 145 HH22 ARG 145 10.662 17.224 4.585 782 H VAL 146 HN VAL 146 5.729 9.370 7.134 783 HA VAL 146 HA VAL 146 3.777 9.461 9.291 784 HB VAL 146 HB VAL 146 2.024 9.077 7.376 785 HG11 VAL 146 HG11 VAL 146 3.124 11.864 7.692 786 HG12 VAL 146 HG12 VAL 146 2.112 11.059 8.904 787 HG13 VAL 146 HG13 VAL 146 1.458 11.394 7.291 788 HG21 VAL 146 HG21 VAL 146 2.547 10.333 5.326 789 HG22 VAL 146 HG22 VAL 146 3.607 8.940 5.539 790 HG23 VAL 146 HG23 VAL 146 4.191 10.566 5.903 791 H ARG 147 HN ARG 147 2.403 7.348 9.092 792 HA ARG 147 HA ARG 147 3.759 5.319 7.514 793 HB2 ARG 147 HB2 ARG 147 4.654 5.611 10.031 794 HB3 ARG 147 HB1 ARG 147 3.315 4.512 10.335 795 HG2 ARG 147 HG2 ARG 147 5.546 4.022 8.369 796 HG3 ARG 147 HG1 ARG 147 5.453 3.346 9.994 797 HD2 ARG 147 HD2 ARG 147 3.253 2.930 8.003 798 HD3 ARG 147 HD1 ARG 147 4.671 1.893 8.010 799 HE ARG 147 HE ARG 147 2.922 2.219 10.372 800 HH11 ARG 147 HH11 ARG 147 4.703 0.205 8.133 801 HH12 ARG 147 HH12 ARG 147 4.350 -1.267 8.973 802 HH21 ARG 147 HH21 ARG 147 2.460 0.255 11.481 803 HH22 ARG 147 HH22 ARG 147 3.107 -1.245 10.876 804 H ILE 148 HN ILE 148 2.202 4.402 6.413 805 HA ILE 148 HA ILE 148 -0.340 3.757 7.670 806 HB ILE 148 HB ILE 148 0.610 3.969 4.918 807 HG12 ILE 148 HG12 ILE 148 -2.088 4.066 6.277 808 HG13 ILE 148 HG11 ILE 148 -1.090 5.411 5.822 809 HG21 ILE 148 HG21 ILE 148 0.463 1.593 4.784 810 HG22 ILE 148 HG22 ILE 148 -0.990 2.254 4.018 811 HG23 ILE 148 HG23 ILE 148 -1.076 1.586 5.649 812 HD11 ILE 148 HD11 ILE 148 -3.016 5.069 4.339 813 HD12 ILE 148 HD12 ILE 148 -2.319 3.517 3.856 814 HD13 ILE 148 HD13 ILE 148 -1.462 5.018 3.510 815 H SER 149 HN SER 149 -0.532 1.942 8.813 816 HA SER 149 HA SER 149 1.326 -0.238 8.506 817 HB2 SER 149 HB2 SER 149 -1.251 -0.389 10.044 818 HB3 SER 149 HB1 SER 149 0.270 -1.222 10.350 819 HG SER 149 HG SER 149 0.140 0.390 11.836 820 H ALA 150 HN ALA 150 0.971 -2.110 7.360 821 HA ALA 150 HA ALA 150 -0.635 -2.124 5.157 822 HB1 ALA 150 HB1 ALA 150 0.098 -4.611 6.689 823 HB2 ALA 150 HB2 ALA 150 1.208 -3.724 5.648 824 HB3 ALA 150 HB3 ALA 150 -0.232 -4.472 4.962 825 H ASP 151 HN ASP 151 -1.380 -3.951 8.113 826 HA ASP 151 HA ASP 151 -3.998 -4.666 7.180 827 HB2 ASP 151 HB2 ASP 151 -2.966 -4.849 10.015 828 HB3 ASP 151 HB1 ASP 151 -4.263 -5.782 9.278 829 H ALA 152 HN ALA 152 -2.722 -2.201 9.379 830 HA ALA 152 HA ALA 152 -5.292 -1.574 10.450 831 HB1 ALA 152 HB1 ALA 152 -2.997 0.343 10.456 832 HB2 ALA 152 HB2 ALA 152 -3.030 -1.072 11.506 833 HB3 ALA 152 HB3 ALA 152 -4.291 0.148 11.635 834 H MET 153 HN MET 153 -3.272 -0.188 7.917 835 HA MET 153 HA MET 153 -5.015 1.806 7.004 836 HB2 MET 153 HB2 MET 153 -2.971 1.918 5.967 837 HB3 MET 153 HB1 MET 153 -2.840 0.171 5.793 838 HG2 MET 153 HG2 MET 153 -5.036 1.302 4.283 839 HG3 MET 153 HG1 MET 153 -3.470 1.955 3.818 840 HE1 MET 153 HE1 MET 153 -2.300 0.996 1.936 841 HE2 MET 153 HE2 MET 153 -1.809 -0.694 1.865 842 HE3 MET 153 HE3 MET 153 -1.371 0.291 3.264 843 H MET 154 HN MET 154 -4.574 -1.531 5.949 844 HA MET 154 HA MET 154 -6.651 -1.899 4.229 845 HB2 MET 154 HB2 MET 154 -5.278 -3.616 6.227 846 HB3 MET 154 HB1 MET 154 -6.723 -4.257 5.499 847 HG2 MET 154 HG2 MET 154 -5.749 -4.067 3.299 848 HG3 MET 154 HG1 MET 154 -4.321 -3.278 3.979 849 HE1 MET 154 HE1 MET 154 -6.382 -6.278 5.426 850 HE2 MET 154 HE2 MET 154 -5.488 -7.663 4.794 851 HE3 MET 154 HE3 MET 154 -6.367 -6.603 3.692 852 H GLN 155 HN GLN 155 -6.777 -2.280 7.765 853 HA GLN 155 HA GLN 155 -9.426 -3.115 7.876 854 HB2 GLN 155 HB2 GLN 155 -7.550 -1.984 9.895 855 HB3 GLN 155 HB1 GLN 155 -9.236 -2.282 10.320 856 HG2 GLN 155 HG2 GLN 155 -9.040 -4.577 9.793 857 HG3 GLN 155 HG1 GLN 155 -7.457 -4.332 9.078 858 HE21 GLN 155 HE21 GLN 155 -5.682 -4.067 10.418 859 HE22 GLN 155 HE22 GLN 155 -5.717 -4.444 12.103 860 H ALA 156 HN ALA 156 -8.015 0.069 7.900 861 HA ALA 156 HA ALA 156 -10.127 1.636 8.745 862 HB1 ALA 156 HB1 ALA 156 -7.853 2.438 8.094 863 HB2 ALA 156 HB2 ALA 156 -9.183 3.440 7.530 864 HB3 ALA 156 HB3 ALA 156 -8.370 2.349 6.411 865 H LEU 157 HN LEU 157 -9.456 0.577 5.410 866 HA LEU 157 HA LEU 157 -12.110 1.363 4.532 867 HB2 LEU 157 HB2 LEU 157 -10.596 -0.249 2.671 868 HB3 LEU 157 HB1 LEU 157 -11.225 1.359 2.472 869 HG LEU 157 HG LEU 157 -9.061 1.700 4.160 870 HD11 LEU 157 HD11 LEU 157 -8.147 0.109 1.807 871 HD12 LEU 157 HD12 LEU 157 -8.564 -0.723 3.314 872 HD13 LEU 157 HD13 LEU 157 -7.280 0.495 3.298 873 HD21 LEU 157 HD21 LEU 157 -8.104 2.579 1.983 874 HD22 LEU 157 HD22 LEU 157 -9.614 3.281 2.554 875 HD23 LEU 157 HD23 LEU 157 -9.620 2.086 1.256 876 H LEU 158 HN LEU 158 -10.485 -1.494 5.535 877 HA LEU 158 HA LEU 158 -11.915 -3.354 3.930 878 HB2 LEU 158 HB2 LEU 158 -9.595 -3.406 5.342 879 HB3 LEU 158 HB1 LEU 158 -10.614 -4.375 6.342 880 HG LEU 158 HG LEU 158 -11.076 -5.417 3.895 881 HD11 LEU 158 HD11 LEU 158 -8.302 -4.365 4.084 882 HD12 LEU 158 HD12 LEU 158 -9.492 -4.095 2.799 883 HD13 LEU 158 HD13 LEU 158 -8.751 -5.694 3.002 884 HD21 LEU 158 HD21 LEU 158 -10.638 -6.772 5.784 885 HD22 LEU 158 HD22 LEU 158 -9.014 -6.104 5.945 886 HD23 LEU 158 HD23 LEU 158 -9.412 -7.148 4.575 887 H GLY 159 HN GLY 159 -13.446 -1.619 5.959 888 HA2 GLY 159 HA2 GLY 159 -14.615 -3.359 7.853 889 HA3 GLY 159 HA1 GLY 159 -15.353 -1.902 7.212 890 H ALA 160 HN ALA 160 -14.664 -5.242 6.425 891 HA ALA 160 HA ALA 160 -17.154 -5.738 5.099 892 HB1 ALA 160 HB1 ALA 160 -16.046 -4.457 3.341 893 HB2 ALA 160 HB2 ALA 160 -16.125 -6.157 2.875 894 HB3 ALA 160 HB3 ALA 160 -14.610 -5.474 3.472 895 H ARG 161 HN ARG 161 -13.733 -6.655 5.130 896 HA ARG 161 HA ARG 161 -14.471 -9.312 6.122 897 HB2 ARG 161 HB2 ARG 161 -12.855 -10.373 4.598 898 HB3 ARG 161 HB1 ARG 161 -14.125 -9.551 3.713 899 HG2 ARG 161 HG2 ARG 161 -12.670 -7.777 3.112 900 HG3 ARG 161 HG1 ARG 161 -11.420 -8.350 4.221 901 HD2 ARG 161 HD2 ARG 161 -12.459 -9.994 1.937 902 HD3 ARG 161 HD1 ARG 161 -11.081 -8.906 1.773 903 HE ARG 161 HE ARG 161 -10.251 -10.358 3.808 904 HH11 ARG 161 HH11 ARG 161 -11.906 -11.448 0.915 905 HH12 ARG 161 HH12 ARG 161 -11.152 -13.007 0.922 906 HH21 ARG 161 HH21 ARG 161 -9.261 -12.394 3.819 907 HH22 ARG 161 HH22 ARG 161 -9.665 -13.566 2.601 908 H ALA 162 HN ALA 162 -13.160 -6.683 7.052 909 HA ALA 162 HA ALA 162 -10.447 -7.229 7.658 910 HB1 ALA 162 HB1 ALA 162 -10.536 -5.327 9.079 911 HB2 ALA 162 HB2 ALA 162 -12.284 -5.435 9.233 912 HB3 ALA 162 HB3 ALA 162 -11.567 -4.977 7.697 913 H LYS 163 HN LYS 163 -13.350 -7.264 9.706 914 HA LYS 163 HA LYS 163 -12.645 -9.646 11.065 915 HB2 LYS 163 HB2 LYS 163 -11.904 -8.885 13.156 916 HB3 LYS 163 HB1 LYS 163 -11.010 -7.883 12.031 917 HG2 LYS 163 HG2 LYS 163 -13.543 -7.033 13.401 918 HG3 LYS 163 HG1 LYS 163 -11.932 -6.728 14.040 919 HD2 LYS 163 HD2 LYS 163 -11.387 -5.299 12.239 920 HD3 LYS 163 HD1 LYS 163 -12.792 -5.830 11.302 921 HE2 LYS 163 HE2 LYS 163 -14.293 -4.816 12.844 922 HE3 LYS 163 HE1 LYS 163 -12.978 -4.438 13.957 923 HZ1 LYS 163 HZ1 LYS 163 -13.407 -3.261 11.266 924 HZ2 LYS 163 HZ2 LYS 163 -12.065 -2.950 12.242 925 HZ3 LYS 163 HZ3 LYS 163 -13.603 -2.476 12.748 926 H GLY 164 HN GLY 164 -14.509 -6.751 10.735 927 HA2 GLY 164 HA2 GLY 164 -16.824 -6.582 10.788 928 HA3 GLY 164 HA1 GLY 164 -16.908 -8.156 11.563 929 H HIS 165 HN HIS 165 -17.496 -8.144 13.631 930 HA HIS 165 HA HIS 165 -17.024 -5.676 15.175 931 HB2 HIS 165 HB2 HIS 165 -19.436 -6.150 14.505 932 HB3 HIS 165 HB1 HIS 165 -19.361 -7.550 15.566 933 HD1 HIS 165 HD1 HIS 165 -19.820 -3.886 15.564 934 HD2 HIS 165 HD2 HIS 165 -19.178 -6.904 18.354 935 HE1 HIS 165 HE1 HIS 165 -20.396 -2.882 17.795 936 HE2 HIS 165 HE2 HIS 165 -19.901 -4.690 19.478 937 HAB 9XG 201 HAB DRG 201 3.390 4.253 5.356 938 HAC 9XG 201 HAC DRG 201 5.039 4.902 5.207 939 HAA 9XG 201 HAA DRG 201 4.786 3.212 5.708 940 HAD 9XG 201 HAD DRG 201 -0.896 3.124 -2.438 941 HAE 9XG 201 HAE DRG 201 -1.798 2.498 -0.212 942 HAF 9XG 201 HAF DRG 201 1.571 3.273 -2.774 943 HAG 9XG 201 HAG DRG 201 6.498 3.586 1.038 944 HAH 9XG 201 HAH DRG 201 6.428 4.381 3.388 945 HAI 9XG 201 HAI DRG 201 -0.247 1.902 1.630 946 HAJ 9XG 201 HAJ DRG 201 3.103 2.556 -0.987 947 HAK 9XG 201 HAK DRG 201 4.544 2.405 0.075 948 HAL 9XG 201 HAL DRG 201 2.470 2.772 3.816 949 HAM 9XG 201 HAM DRG 201 2.198 0.921 1.799 Start of MODEL 5 1 H1 MET 1 HT1 MET 1 10.253 -0.047 -5.126 2 H2 MET 1 HT2 MET 1 11.182 -1.014 -6.162 3 H3 MET 1 HT3 MET 1 11.672 -0.778 -4.563 4 HA MET 1 HA MET 1 9.746 -1.950 -3.748 5 HB2 MET 1 HB2 MET 1 8.194 -1.416 -5.537 6 HB3 MET 1 HB1 MET 1 9.163 -2.332 -6.684 7 HG2 MET 1 HG2 MET 1 7.167 -3.526 -5.959 8 HG3 MET 1 HG1 MET 1 8.636 -4.399 -5.569 9 HE1 MET 1 HE1 MET 1 6.994 -1.324 -3.539 10 HE2 MET 1 HE2 MET 1 5.918 -2.256 -2.502 11 HE3 MET 1 HE3 MET 1 5.690 -2.265 -4.252 12 H ASP 2 HN ASP 2 10.649 -3.674 -2.894 13 HA ASP 2 HA ASP 2 12.729 -5.156 -4.121 14 HB2 ASP 2 HB2 ASP 2 10.972 -6.112 -1.918 15 HB3 ASP 2 HB1 ASP 2 12.620 -6.596 -2.224 16 H ASP 3 HN ASP 3 12.461 -6.596 -5.758 17 HA ASP 3 HA ASP 3 9.852 -7.478 -6.465 18 HB2 ASP 3 HB2 ASP 3 10.871 -8.749 -8.233 19 HB3 ASP 3 HB1 ASP 3 11.626 -7.169 -8.146 20 H ILE 4 HN ILE 4 12.085 -8.540 -4.207 21 HA ILE 4 HA ILE 4 11.490 -11.202 -3.862 22 HB ILE 4 HB ILE 4 13.077 -9.890 -2.476 23 HG12 ILE 4 HG12 ILE 4 12.118 -12.110 -1.714 24 HG13 ILE 4 HG11 ILE 4 12.859 -11.085 -0.491 25 HG21 ILE 4 HG21 ILE 4 12.428 -8.431 -0.784 26 HG22 ILE 4 HG22 ILE 4 10.746 -8.957 -0.876 27 HG23 ILE 4 HG23 ILE 4 11.437 -8.005 -2.182 28 HD11 ILE 4 HD11 ILE 4 10.815 -12.126 0.327 29 HD12 ILE 4 HD12 ILE 4 9.909 -11.371 -0.985 30 HD13 ILE 4 HD13 ILE 4 10.662 -10.371 0.254 31 H TYR 5 HN TYR 5 9.637 -8.365 -2.885 32 HA TYR 5 HA TYR 5 7.410 -9.887 -1.894 33 HB2 TYR 5 HB2 TYR 5 7.756 -6.924 -2.423 34 HB3 TYR 5 HB1 TYR 5 6.334 -7.638 -1.665 35 HD1 TYR 5 HD1 TYR 5 6.844 -9.206 0.364 36 HD2 TYR 5 HD2 TYR 5 9.454 -6.164 -1.016 37 HE1 TYR 5 HE1 TYR 5 7.899 -9.130 2.552 38 HE2 TYR 5 HE2 TYR 5 10.517 -6.071 1.180 39 HH TYR 5 HH TYR 5 10.075 -6.625 3.456 40 H LYS 6 HN LYS 6 8.360 -8.368 -4.846 41 HA LYS 6 HA LYS 6 5.821 -8.403 -6.084 42 HB2 LYS 6 HB2 LYS 6 8.575 -8.420 -7.313 43 HB3 LYS 6 HB1 LYS 6 7.077 -8.211 -8.205 44 HG2 LYS 6 HG2 LYS 6 6.601 -6.163 -6.909 45 HG3 LYS 6 HG1 LYS 6 8.122 -6.389 -6.052 46 HD2 LYS 6 HD2 LYS 6 8.407 -4.734 -7.777 47 HD3 LYS 6 HD1 LYS 6 9.330 -6.175 -8.197 48 HE2 LYS 6 HE2 LYS 6 7.563 -6.870 -9.722 49 HE3 LYS 6 HE1 LYS 6 6.608 -5.459 -9.275 50 HZ1 LYS 6 HZ1 LYS 6 9.277 -5.355 -10.575 51 HZ2 LYS 6 HZ2 LYS 6 8.280 -4.029 -10.233 52 HZ3 LYS 6 HZ3 LYS 6 7.801 -5.181 -11.377 53 H ALA 7 HN ALA 7 8.325 -10.774 -5.598 54 HA ALA 7 HA ALA 7 6.932 -12.933 -6.907 55 HB1 ALA 7 HB1 ALA 7 9.183 -13.380 -6.558 56 HB2 ALA 7 HB2 ALA 7 8.375 -14.294 -5.274 57 HB3 ALA 7 HB3 ALA 7 9.160 -12.751 -4.904 58 H ALA 8 HN ALA 8 6.822 -11.447 -3.707 59 HA ALA 8 HA ALA 8 5.670 -13.651 -2.392 60 HB1 ALA 8 HB1 ALA 8 6.683 -11.727 -1.231 61 HB2 ALA 8 HB2 ALA 8 5.115 -12.238 -0.615 62 HB3 ALA 8 HB3 ALA 8 5.242 -10.800 -1.633 63 H VAL 9 HN VAL 9 4.348 -11.080 -4.309 64 HA VAL 9 HA VAL 9 1.598 -11.711 -3.740 65 HB VAL 9 HB VAL 9 1.965 -9.485 -4.449 66 HG11 VAL 9 HG11 VAL 9 3.062 -8.915 -6.594 67 HG12 VAL 9 HG12 VAL 9 3.467 -10.622 -6.797 68 HG13 VAL 9 HG13 VAL 9 4.134 -9.715 -5.442 69 HG21 VAL 9 HG21 VAL 9 0.688 -9.295 -6.559 70 HG22 VAL 9 HG22 VAL 9 -0.035 -10.422 -5.409 71 HG23 VAL 9 HG23 VAL 9 0.873 -11.035 -6.789 72 H GLU 10 HN GLU 10 4.034 -12.828 -5.903 73 HA GLU 10 HA GLU 10 2.298 -14.441 -7.502 74 HB2 GLU 10 HB2 GLU 10 5.196 -15.031 -7.120 75 HB3 GLU 10 HB1 GLU 10 4.225 -15.152 -8.588 76 HG2 GLU 10 HG2 GLU 10 4.087 -12.658 -8.519 77 HG3 GLU 10 HG1 GLU 10 5.224 -12.711 -7.237 78 H GLN 11 HN GLN 11 3.962 -14.549 -4.571 79 HA GLN 11 HA GLN 11 3.797 -17.347 -3.968 80 HB2 GLN 11 HB2 GLN 11 5.668 -16.119 -3.209 81 HB3 GLN 11 HB1 GLN 11 4.654 -14.911 -2.524 82 HG2 GLN 11 HG2 GLN 11 5.718 -16.365 -0.908 83 HG3 GLN 11 HG1 GLN 11 3.982 -16.325 -0.832 84 HE21 GLN 11 HE21 GLN 11 3.869 -18.262 0.274 85 HE22 GLN 11 HE22 GLN 11 4.198 -19.784 -0.479 86 H LEU 12 HN LEU 12 1.888 -14.470 -3.339 87 HA LEU 12 HA LEU 12 0.416 -15.487 -1.160 88 HB2 LEU 12 HB2 LEU 12 -0.410 -13.305 -3.055 89 HB3 LEU 12 HB1 LEU 12 -1.175 -13.687 -1.599 90 HG LEU 12 HG LEU 12 1.678 -12.839 -1.630 91 HD11 LEU 12 HD11 LEU 12 0.050 -11.161 -2.696 92 HD12 LEU 12 HD12 LEU 12 1.064 -10.594 -1.372 93 HD13 LEU 12 HD13 LEU 12 -0.622 -10.993 -1.081 94 HD21 LEU 12 HD21 LEU 12 -0.494 -13.029 0.471 95 HD22 LEU 12 HD22 LEU 12 1.066 -12.244 0.734 96 HD23 LEU 12 HD23 LEU 12 1.007 -13.969 0.368 97 H THR 13 HN THR 13 -1.750 -16.154 -1.109 98 HA THR 13 HA THR 13 -2.459 -17.859 -3.304 99 HB THR 13 HB THR 13 -4.303 -18.602 -1.947 100 HG1 THR 13 HG1 THR 13 -4.605 -17.579 0.165 101 HG21 THR 13 HG21 THR 13 -1.894 -18.162 -0.200 102 HG22 THR 13 HG22 THR 13 -2.116 -19.497 -1.324 103 HG23 THR 13 HG23 THR 13 -3.162 -19.348 0.082 104 H GLU 14 HN GLU 14 -4.905 -17.824 -3.870 105 HA GLU 14 HA GLU 14 -5.569 -15.532 -5.270 106 HB2 GLU 14 HB2 GLU 14 -6.827 -17.278 -5.996 107 HB3 GLU 14 HB1 GLU 14 -7.001 -17.958 -4.387 108 HG2 GLU 14 HG2 GLU 14 -8.718 -16.470 -3.852 109 HG3 GLU 14 HG1 GLU 14 -8.401 -15.497 -5.267 110 H GLU 15 HN GLU 15 -6.898 -16.635 -2.181 111 HA GLU 15 HA GLU 15 -8.416 -14.294 -1.763 112 HB2 GLU 15 HB2 GLU 15 -7.500 -16.384 0.201 113 HB3 GLU 15 HB1 GLU 15 -8.600 -15.072 0.604 114 HG2 GLU 15 HG2 GLU 15 -10.132 -15.882 -1.163 115 HG3 GLU 15 HG1 GLU 15 -9.063 -17.263 -1.400 116 H GLN 16 HN GLN 16 -5.117 -15.088 -1.003 117 HA GLN 16 HA GLN 16 -4.531 -13.168 0.903 118 HB2 GLN 16 HB2 GLN 16 -2.950 -14.449 -1.246 119 HB3 GLN 16 HB1 GLN 16 -2.241 -13.255 -0.194 120 HG2 GLN 16 HG2 GLN 16 -3.602 -15.730 0.735 121 HG3 GLN 16 HG1 GLN 16 -1.887 -15.629 0.479 122 HE21 GLN 16 HE21 GLN 16 -4.546 -14.851 2.448 123 HE22 GLN 16 HE22 GLN 16 -3.668 -14.278 3.818 124 H LYS 17 HN LYS 17 -4.422 -13.014 -2.579 125 HA LYS 17 HA LYS 17 -3.621 -10.274 -2.585 126 HB2 LYS 17 HB2 LYS 17 -4.634 -11.970 -4.884 127 HB3 LYS 17 HB1 LYS 17 -3.677 -10.491 -5.000 128 HG2 LYS 17 HG2 LYS 17 -1.745 -11.542 -4.171 129 HG3 LYS 17 HG1 LYS 17 -2.654 -12.932 -3.584 130 HD2 LYS 17 HD2 LYS 17 -1.327 -13.327 -5.670 131 HD3 LYS 17 HD1 LYS 17 -3.051 -13.700 -5.801 132 HE2 LYS 17 HE2 LYS 17 -3.396 -11.469 -6.789 133 HE3 LYS 17 HE1 LYS 17 -1.674 -11.189 -6.700 134 HZ1 LYS 17 HZ1 LYS 17 -2.995 -13.338 -8.303 135 HZ2 LYS 17 HZ2 LYS 17 -1.328 -13.062 -8.219 136 HZ3 LYS 17 HZ3 LYS 17 -2.333 -11.912 -8.932 137 H ASN 18 HN ASN 18 -6.585 -12.002 -2.593 138 HA ASN 18 HA ASN 18 -8.161 -9.998 -3.887 139 HB2 ASN 18 HB2 ASN 18 -8.759 -12.372 -3.980 140 HB3 ASN 18 HB1 ASN 18 -8.985 -12.392 -2.236 141 HD21 ASN 18 HD21 ASN 18 -10.205 -11.121 -5.256 142 HD22 ASN 18 HD22 ASN 18 -11.807 -10.805 -4.682 143 H GLU 19 HN GLU 19 -7.478 -10.904 -0.576 144 HA GLU 19 HA GLU 19 -9.206 -9.169 0.785 145 HB2 GLU 19 HB2 GLU 19 -7.612 -10.973 1.667 146 HB3 GLU 19 HB1 GLU 19 -6.397 -9.716 1.620 147 HG2 GLU 19 HG2 GLU 19 -7.261 -8.621 3.366 148 HG3 GLU 19 HG1 GLU 19 -8.919 -9.036 2.984 149 H PHE 20 HN PHE 20 -5.941 -8.769 -0.271 150 HA PHE 20 HA PHE 20 -5.568 -6.120 0.581 151 HB2 PHE 20 HB2 PHE 20 -4.115 -7.585 -1.625 152 HB3 PHE 20 HB1 PHE 20 -3.488 -6.263 -0.649 153 HD1 PHE 20 HD1 PHE 20 -4.939 -7.787 1.901 154 HD2 PHE 20 HD2 PHE 20 -2.018 -8.747 -0.992 155 HE1 PHE 20 HE1 PHE 20 -3.999 -9.489 3.412 156 HE2 PHE 20 HE2 PHE 20 -1.049 -10.415 0.502 157 HZ PHE 20 HZ PHE 20 -2.037 -10.818 2.704 158 H LYS 21 HN LYS 21 -6.603 -7.507 -2.506 159 HA LYS 21 HA LYS 21 -6.789 -5.366 -4.195 160 HB2 LYS 21 HB2 LYS 21 -7.555 -7.373 -5.015 161 HB3 LYS 21 HB1 LYS 21 -8.614 -7.633 -3.681 162 HG2 LYS 21 HG2 LYS 21 -9.776 -7.139 -5.810 163 HG3 LYS 21 HG1 LYS 21 -10.161 -6.026 -4.501 164 HD2 LYS 21 HD2 LYS 21 -8.245 -4.593 -5.548 165 HD3 LYS 21 HD1 LYS 21 -8.589 -5.557 -6.991 166 HE2 LYS 21 HE2 LYS 21 -10.947 -4.498 -5.596 167 HE3 LYS 21 HE1 LYS 21 -9.913 -3.273 -6.309 168 HZ1 LYS 21 HZ1 LYS 21 -10.101 -4.454 -8.433 169 HZ2 LYS 21 HZ2 LYS 21 -11.611 -3.978 -7.850 170 HZ3 LYS 21 HZ3 LYS 21 -11.131 -5.590 -7.717 171 H ALA 22 HN ALA 22 -9.212 -6.378 -1.901 172 HA ALA 22 HA ALA 22 -11.026 -4.432 -2.448 173 HB1 ALA 22 HB1 ALA 22 -10.531 -5.603 0.283 174 HB2 ALA 22 HB2 ALA 22 -11.484 -6.359 -0.997 175 HB3 ALA 22 HB3 ALA 22 -12.019 -4.841 -0.278 176 H ALA 23 HN ALA 23 -8.429 -4.352 -0.033 177 HA ALA 23 HA ALA 23 -8.889 -1.804 0.986 178 HB1 ALA 23 HB1 ALA 23 -7.355 -3.246 2.094 179 HB2 ALA 23 HB2 ALA 23 -6.452 -1.825 1.567 180 HB3 ALA 23 HB3 ALA 23 -6.317 -3.339 0.675 181 H PHE 24 HN PHE 24 -6.998 -2.755 -1.875 182 HA PHE 24 HA PHE 24 -6.109 -0.264 -2.752 183 HB2 PHE 24 HB2 PHE 24 -5.536 -2.371 -3.858 184 HB3 PHE 24 HB1 PHE 24 -7.183 -2.597 -4.290 185 HD1 PHE 24 HD1 PHE 24 -7.578 -2.450 -6.478 186 HD2 PHE 24 HD2 PHE 24 -4.752 0.230 -4.792 187 HE1 PHE 24 HE1 PHE 24 -7.311 -1.363 -8.660 188 HE2 PHE 24 HE2 PHE 24 -4.467 1.311 -6.974 189 HZ PHE 24 HZ PHE 24 -5.750 0.513 -8.915 190 H ASP 25 HN ASP 25 -8.947 -2.003 -3.645 191 HA ASP 25 HA ASP 25 -10.229 -0.154 -5.277 192 HB2 ASP 25 HB2 ASP 25 -10.734 -2.608 -4.919 193 HB3 ASP 25 HB1 ASP 25 -11.628 -2.130 -3.530 194 H ILE 26 HN ILE 26 -10.355 -0.419 -1.790 195 HA ILE 26 HA ILE 26 -12.535 1.502 -1.583 196 HB ILE 26 HB ILE 26 -10.881 0.113 0.478 197 HG12 ILE 26 HG12 ILE 26 -13.707 -0.511 -0.189 198 HG13 ILE 26 HG11 ILE 26 -12.428 -1.111 -1.200 199 HG21 ILE 26 HG21 ILE 26 -12.029 2.273 1.175 200 HG22 ILE 26 HG22 ILE 26 -12.407 0.843 2.133 201 HG23 ILE 26 HG23 ILE 26 -13.553 1.414 0.918 202 HD11 ILE 26 HD11 ILE 26 -11.516 -2.357 0.637 203 HD12 ILE 26 HD12 ILE 26 -13.214 -2.760 0.397 204 HD13 ILE 26 HD13 ILE 26 -12.742 -1.701 1.725 205 H PHE 27 HN PHE 27 -9.138 1.265 -1.412 206 HA PHE 27 HA PHE 27 -8.476 3.760 -0.290 207 HB2 PHE 27 HB2 PHE 27 -7.173 1.624 -1.705 208 HB3 PHE 27 HB1 PHE 27 -6.680 3.158 -2.373 209 HD1 PHE 27 HD1 PHE 27 -5.342 4.737 -1.115 210 HD2 PHE 27 HD2 PHE 27 -6.741 1.080 0.513 211 HE1 PHE 27 HE1 PHE 27 -3.835 5.008 0.827 212 HE2 PHE 27 HE2 PHE 27 -5.235 1.343 2.419 213 HZ PHE 27 HZ PHE 27 -3.819 3.305 2.589 214 H VAL 28 HN VAL 28 -9.649 2.677 -3.320 215 HA VAL 28 HA VAL 28 -9.204 5.311 -4.524 216 HB VAL 28 HB VAL 28 -9.710 4.232 -6.701 217 HG11 VAL 28 HG11 VAL 28 -7.480 2.943 -5.185 218 HG12 VAL 28 HG12 VAL 28 -7.444 4.584 -5.821 219 HG13 VAL 28 HG13 VAL 28 -7.567 3.217 -6.919 220 HG21 VAL 28 HG21 VAL 28 -10.998 2.321 -5.699 221 HG22 VAL 28 HG22 VAL 28 -9.443 1.621 -5.245 222 HG23 VAL 28 HG23 VAL 28 -9.832 1.892 -6.943 223 H LEU 29 HN LEU 29 -11.389 4.831 -2.623 224 HA LEU 29 HA LEU 29 -13.817 4.316 -3.956 225 HB2 LEU 29 HB2 LEU 29 -13.355 5.949 -1.455 226 HB3 LEU 29 HB1 LEU 29 -14.938 5.500 -2.049 227 HG LEU 29 HG LEU 29 -12.812 3.557 -1.161 228 HD11 LEU 29 HD11 LEU 29 -13.744 4.902 0.696 229 HD12 LEU 29 HD12 LEU 29 -14.132 3.186 0.804 230 HD13 LEU 29 HD13 LEU 29 -15.357 4.334 0.255 231 HD21 LEU 29 HD21 LEU 29 -15.691 3.129 -1.939 232 HD22 LEU 29 HD22 LEU 29 -14.625 1.912 -1.242 233 HD23 LEU 29 HD23 LEU 29 -14.268 2.587 -2.832 234 H GLY 30 HN GLY 30 -14.647 5.368 -5.574 235 HA2 GLY 30 HA2 GLY 30 -15.624 7.124 -6.708 236 HA3 GLY 30 HA1 GLY 30 -15.003 8.233 -5.496 237 H ALA 31 HN ALA 31 -12.585 6.178 -6.743 238 HA ALA 31 HA ALA 31 -11.231 8.394 -7.965 239 HB1 ALA 31 HB1 ALA 31 -10.533 5.464 -7.931 240 HB2 ALA 31 HB2 ALA 31 -9.957 6.687 -6.798 241 HB3 ALA 31 HB3 ALA 31 -9.474 6.750 -8.495 242 H GLU 32 HN GLU 32 -10.733 8.733 -10.065 243 HA GLU 32 HA GLU 32 -12.746 7.972 -11.961 244 HB2 GLU 32 HB2 GLU 32 -10.240 9.629 -12.256 245 HB3 GLU 32 HB1 GLU 32 -11.570 9.561 -13.415 246 HG2 GLU 32 HG2 GLU 32 -13.052 10.618 -11.940 247 HG3 GLU 32 HG1 GLU 32 -11.981 10.370 -10.564 248 H ASP 33 HN ASP 33 -9.379 7.199 -11.353 249 HA ASP 33 HA ASP 33 -9.368 5.460 -13.706 250 HB2 ASP 33 HB2 ASP 33 -7.390 7.008 -13.233 251 HB3 ASP 33 HB1 ASP 33 -7.054 5.963 -11.868 252 H GLY 34 HN GLY 34 -9.681 5.434 -10.323 253 HA2 GLY 34 HA2 GLY 34 -10.099 3.725 -8.839 254 HA3 GLY 34 HA1 GLY 34 -10.139 2.617 -10.198 255 H SER 35 HN SER 35 -7.372 4.499 -10.090 256 HA SER 35 HA SER 35 -5.825 2.475 -8.623 257 HB2 SER 35 HB2 SER 35 -4.690 4.303 -10.748 258 HB3 SER 35 HB1 SER 35 -3.905 2.947 -9.996 259 HG SER 35 HG SER 35 -5.866 3.015 -11.985 260 H ILE 36 HN ILE 36 -4.240 3.341 -7.212 261 HA ILE 36 HA ILE 36 -5.544 5.434 -5.728 262 HB ILE 36 HB ILE 36 -3.068 3.754 -5.256 263 HG12 ILE 36 HG12 ILE 36 -5.500 3.955 -3.533 264 HG13 ILE 36 HG11 ILE 36 -5.520 2.933 -4.979 265 HG21 ILE 36 HG21 ILE 36 -4.169 5.941 -3.491 266 HG22 ILE 36 HG22 ILE 36 -2.582 5.908 -4.258 267 HG23 ILE 36 HG23 ILE 36 -2.976 4.756 -2.983 268 HD11 ILE 36 HD11 ILE 36 -3.602 1.688 -4.061 269 HD12 ILE 36 HD12 ILE 36 -5.014 1.628 -3.009 270 HD13 ILE 36 HD13 ILE 36 -3.667 2.694 -2.617 271 H SER 37 HN SER 37 -5.315 7.375 -6.491 272 HA SER 37 HA SER 37 -2.738 8.508 -7.113 273 HB2 SER 37 HB2 SER 37 -4.140 10.651 -7.111 274 HB3 SER 37 HB1 SER 37 -4.530 9.444 -8.334 275 HG SER 37 HG SER 37 -6.463 9.813 -7.509 276 H THR 38 HN THR 38 -2.126 10.563 -5.803 277 HA THR 38 HA THR 38 -1.374 9.546 -3.324 278 HB THR 38 HB THR 38 -0.787 12.013 -2.880 279 HG1 THR 38 HG1 THR 38 -2.234 12.368 -4.999 280 HG21 THR 38 HG21 THR 38 1.193 11.731 -4.349 281 HG22 THR 38 HG22 THR 38 0.374 10.381 -5.146 282 HG23 THR 38 HG23 THR 38 0.805 10.266 -3.435 283 H LYS 39 HN LYS 39 -3.993 11.844 -4.006 284 HA LYS 39 HA LYS 39 -4.464 12.207 -1.217 285 HB2 LYS 39 HB2 LYS 39 -5.203 13.515 -3.544 286 HB3 LYS 39 HB1 LYS 39 -6.693 13.008 -2.770 287 HG2 LYS 39 HG2 LYS 39 -4.463 14.630 -1.557 288 HG3 LYS 39 HG1 LYS 39 -6.083 15.149 -1.937 289 HD2 LYS 39 HD2 LYS 39 -7.035 13.982 -0.166 290 HD3 LYS 39 HD1 LYS 39 -5.641 12.921 -0.008 291 HE2 LYS 39 HE2 LYS 39 -5.755 14.537 1.830 292 HE3 LYS 39 HE1 LYS 39 -4.304 14.751 0.855 293 HZ1 LYS 39 HZ1 LYS 39 -5.354 16.611 -0.275 294 HZ2 LYS 39 HZ2 LYS 39 -5.355 16.873 1.394 295 HZ3 LYS 39 HZ3 LYS 39 -6.778 16.394 0.615 296 H GLU 40 HN GLU 40 -5.773 10.125 -3.745 297 HA GLU 40 HA GLU 40 -7.747 8.841 -2.222 298 HB2 GLU 40 HB2 GLU 40 -6.081 8.141 -4.563 299 HB3 GLU 40 HB1 GLU 40 -6.663 6.771 -3.633 300 HG2 GLU 40 HG2 GLU 40 -8.032 7.672 -5.633 301 HG3 GLU 40 HG1 GLU 40 -8.821 7.140 -4.169 302 H LEU 41 HN LEU 41 -4.253 8.197 -2.466 303 HA LEU 41 HA LEU 41 -4.010 6.241 -0.465 304 HB2 LEU 41 HB2 LEU 41 -2.199 6.780 -1.998 305 HB3 LEU 41 HB1 LEU 41 -2.135 8.413 -1.414 306 HG LEU 41 HG LEU 41 -1.215 7.656 0.691 307 HD11 LEU 41 HD11 LEU 41 -1.878 4.971 -0.442 308 HD12 LEU 41 HD12 LEU 41 -2.000 5.566 1.228 309 HD13 LEU 41 HD13 LEU 41 -0.428 5.119 0.569 310 HD21 LEU 41 HD21 LEU 41 0.955 6.907 -0.225 311 HD22 LEU 41 HD22 LEU 41 0.246 8.222 -1.147 312 HD23 LEU 41 HD23 LEU 41 0.166 6.586 -1.772 313 H GLY 42 HN GLY 42 -3.934 9.792 -0.274 314 HA2 GLY 42 HA2 GLY 42 -3.140 10.042 2.406 315 HA3 GLY 42 HA1 GLY 42 -3.941 11.282 1.457 316 H LYS 43 HN LYS 43 -6.243 9.705 0.881 317 HA LYS 43 HA LYS 43 -8.055 10.484 2.805 318 HB2 LYS 43 HB2 LYS 43 -8.809 9.772 0.668 319 HB3 LYS 43 HB1 LYS 43 -8.043 8.201 0.846 320 HG2 LYS 43 HG2 LYS 43 -9.770 8.133 2.928 321 HG3 LYS 43 HG1 LYS 43 -10.653 9.156 1.796 322 HD2 LYS 43 HD2 LYS 43 -10.202 7.427 0.034 323 HD3 LYS 43 HD1 LYS 43 -9.575 6.385 1.303 324 HE2 LYS 43 HE2 LYS 43 -11.811 5.727 0.915 325 HE3 LYS 43 HE1 LYS 43 -11.804 6.610 2.438 326 HZ1 LYS 43 HZ1 LYS 43 -12.472 7.901 -0.139 327 HZ2 LYS 43 HZ2 LYS 43 -12.771 8.478 1.423 328 HZ3 LYS 43 HZ3 LYS 43 -13.639 7.159 0.829 329 H VAL 44 HN VAL 44 -6.459 7.374 2.392 330 HA VAL 44 HA VAL 44 -7.906 6.181 4.557 331 HB VAL 44 HB VAL 44 -5.652 5.054 2.882 332 HG11 VAL 44 HG11 VAL 44 -7.446 3.673 4.923 333 HG12 VAL 44 HG12 VAL 44 -5.725 3.995 5.126 334 HG13 VAL 44 HG13 VAL 44 -6.265 2.865 3.884 335 HG21 VAL 44 HG21 VAL 44 -7.514 3.716 1.901 336 HG22 VAL 44 HG22 VAL 44 -7.665 5.449 1.593 337 HG23 VAL 44 HG23 VAL 44 -8.658 4.680 2.848 338 H MET 45 HN MET 45 -4.643 7.334 3.994 339 HA MET 45 HA MET 45 -3.473 6.670 6.445 340 HB2 MET 45 HB2 MET 45 -3.172 9.166 4.780 341 HB3 MET 45 HB1 MET 45 -2.083 8.650 6.046 342 HG2 MET 45 HG2 MET 45 -2.526 6.688 3.904 343 HG3 MET 45 HG1 MET 45 -1.699 8.156 3.441 344 HE1 MET 45 HE1 MET 45 0.299 9.035 4.358 345 HE2 MET 45 HE2 MET 45 1.269 8.350 5.652 346 HE3 MET 45 HE3 MET 45 -0.333 8.998 6.003 347 H ARG 46 HN ARG 46 -5.557 9.415 5.534 348 HA ARG 46 HA ARG 46 -5.584 10.577 8.118 349 HB2 ARG 46 HB2 ARG 46 -7.011 10.945 5.563 350 HB3 ARG 46 HB1 ARG 46 -7.726 11.625 7.005 351 HG2 ARG 46 HG2 ARG 46 -6.272 13.278 7.030 352 HG3 ARG 46 HG1 ARG 46 -4.932 12.130 6.969 353 HD2 ARG 46 HD2 ARG 46 -4.812 13.524 5.107 354 HD3 ARG 46 HD1 ARG 46 -5.248 11.928 4.561 355 HE ARG 46 HE ARG 46 -7.511 12.712 4.220 356 HH11 ARG 46 HH11 ARG 46 -5.121 15.202 4.723 357 HH12 ARG 46 HH12 ARG 46 -6.112 16.464 4.068 358 HH21 ARG 46 HH21 ARG 46 -8.827 14.378 3.364 359 HH22 ARG 46 HH22 ARG 46 -8.213 16.000 3.303 360 H MET 47 HN MET 47 -7.546 8.184 6.456 361 HA MET 47 HA MET 47 -9.602 7.855 8.301 362 HB2 MET 47 HB2 MET 47 -8.226 6.174 6.283 363 HB3 MET 47 HB1 MET 47 -9.423 5.463 7.281 364 HG2 MET 47 HG2 MET 47 -11.113 6.931 6.423 365 HG3 MET 47 HG1 MET 47 -9.895 7.808 5.501 366 HE1 MET 47 HE1 MET 47 -11.402 3.544 4.616 367 HE2 MET 47 HE2 MET 47 -12.018 4.612 5.875 368 HE3 MET 47 HE3 MET 47 -10.421 3.884 6.041 369 H LEU 48 HN LEU 48 -6.252 7.127 8.408 370 HA LEU 48 HA LEU 48 -6.569 5.262 10.631 371 HB2 LEU 48 HB2 LEU 48 -4.114 6.007 9.124 372 HB3 LEU 48 HB1 LEU 48 -4.225 4.749 10.311 373 HG LEU 48 HG LEU 48 -5.441 4.812 7.573 374 HD11 LEU 48 HD11 LEU 48 -4.032 2.968 7.118 375 HD12 LEU 48 HD12 LEU 48 -3.606 2.777 8.817 376 HD13 LEU 48 HD13 LEU 48 -3.026 4.179 7.914 377 HD21 LEU 48 HD21 LEU 48 -5.911 2.791 9.767 378 HD22 LEU 48 HD22 LEU 48 -6.421 2.626 8.089 379 HD23 LEU 48 HD23 LEU 48 -7.104 3.902 9.094 380 H GLY 49 HN GLY 49 -6.313 8.506 10.288 381 HA2 GLY 49 HA2 GLY 49 -6.054 9.979 12.121 382 HA3 GLY 49 HA1 GLY 49 -5.118 8.743 12.944 383 H GLN 50 HN GLN 50 -3.970 8.868 9.848 384 HA GLN 50 HA GLN 50 -1.647 10.364 10.605 385 HB2 GLN 50 HB2 GLN 50 -2.356 9.340 7.874 386 HB3 GLN 50 HB1 GLN 50 -0.781 9.804 8.467 387 HG2 GLN 50 HG2 GLN 50 -2.284 7.521 9.688 388 HG3 GLN 50 HG1 GLN 50 -1.282 7.287 8.249 389 HE21 GLN 50 HE21 GLN 50 -1.102 6.299 10.994 390 HE22 GLN 50 HE22 GLN 50 0.486 6.713 11.533 391 H ASN 51 HN ASN 51 -0.871 12.049 9.027 392 HA ASN 51 HA ASN 51 -2.985 13.327 7.514 393 HB2 ASN 51 HB2 ASN 51 -2.291 15.576 8.491 394 HB3 ASN 51 HB1 ASN 51 -3.257 14.523 9.515 395 HD21 ASN 51 HD21 ASN 51 -2.360 13.607 11.326 396 HD22 ASN 51 HD22 ASN 51 -0.819 14.078 11.953 397 HA PRO 52 HA PRO 52 1.189 12.810 5.345 398 HB2 PRO 52 HB2 PRO 52 -0.274 12.447 3.015 399 HB3 PRO 52 HB1 PRO 52 0.453 11.191 3.969 400 HG2 PRO 52 HG2 PRO 52 -2.351 12.110 3.857 401 HG3 PRO 52 HG1 PRO 52 -1.720 10.485 4.167 402 HD2 PRO 52 HD2 PRO 52 -2.735 12.004 6.095 403 HD3 PRO 52 HD1 PRO 52 -1.392 10.938 6.388 404 H THR 53 HN THR 53 2.052 14.096 3.733 405 HA THR 53 HA THR 53 0.201 15.927 2.432 406 HB THR 53 HB THR 53 2.203 17.257 1.722 407 HG1 THR 53 HG1 THR 53 4.196 16.801 2.551 408 HG21 THR 53 HG21 THR 53 2.609 18.373 3.847 409 HG22 THR 53 HG22 THR 53 1.940 16.996 4.722 410 HG23 THR 53 HG23 THR 53 0.902 17.972 3.681 411 HA PRO 54 HA PRO 54 0.455 13.696 -1.324 412 HB2 PRO 54 HB2 PRO 54 1.059 16.368 -2.456 413 HB3 PRO 54 HB1 PRO 54 -0.070 15.145 -3.028 414 HG2 PRO 54 HG2 PRO 54 -0.980 17.164 -1.677 415 HG3 PRO 54 HG1 PRO 54 -1.538 15.553 -1.281 416 HD2 PRO 54 HD2 PRO 54 0.438 17.275 0.148 417 HD3 PRO 54 HD1 PRO 54 -0.838 16.233 0.816 418 H GLU 55 HN GLU 55 3.050 15.828 -0.421 419 HA GLU 55 HA GLU 55 5.097 15.129 -2.173 420 HB2 GLU 55 HB2 GLU 55 5.171 15.608 0.779 421 HB3 GLU 55 HB1 GLU 55 6.545 15.700 -0.257 422 HG2 GLU 55 HG2 GLU 55 5.623 17.549 -1.341 423 HG3 GLU 55 HG1 GLU 55 4.159 17.390 -0.428 424 H GLU 56 HN GLU 56 4.581 13.945 1.048 425 HA GLU 56 HA GLU 56 6.167 11.713 1.075 426 HB2 GLU 56 HB2 GLU 56 3.586 12.414 2.445 427 HB3 GLU 56 HB1 GLU 56 4.636 11.123 2.963 428 HG2 GLU 56 HG2 GLU 56 6.405 13.104 2.865 429 HG3 GLU 56 HG1 GLU 56 4.936 14.020 3.118 430 H LEU 57 HN LEU 57 2.673 11.906 0.724 431 HA LEU 57 HA LEU 57 1.988 9.320 0.175 432 HB2 LEU 57 HB2 LEU 57 0.806 11.797 -1.055 433 HB3 LEU 57 HB1 LEU 57 0.051 10.212 -1.084 434 HG LEU 57 HG LEU 57 0.799 11.560 1.489 435 HD11 LEU 57 HD11 LEU 57 -1.617 12.005 -0.223 436 HD12 LEU 57 HD12 LEU 57 -0.632 13.171 0.667 437 HD13 LEU 57 HD13 LEU 57 -1.725 12.104 1.541 438 HD21 LEU 57 HD21 LEU 57 -0.844 10.050 2.447 439 HD22 LEU 57 HD22 LEU 57 0.342 9.140 1.503 440 HD23 LEU 57 HD23 LEU 57 -1.254 9.454 0.822 441 H GLN 58 HN GLN 58 3.191 11.703 -2.172 442 HA GLN 58 HA GLN 58 2.758 10.019 -4.422 443 HB2 GLN 58 HB2 GLN 58 3.040 12.544 -4.461 444 HB3 GLN 58 HB1 GLN 58 4.763 12.262 -4.257 445 HG2 GLN 58 HG2 GLN 58 4.902 11.129 -6.343 446 HG3 GLN 58 HG1 GLN 58 3.148 11.123 -6.521 447 HE21 GLN 58 HE21 GLN 58 4.932 13.860 -5.301 448 HE22 GLN 58 HE22 GLN 58 4.660 14.887 -6.663 449 H GLU 59 HN GLU 59 5.517 10.737 -2.381 450 HA GLU 59 HA GLU 59 7.313 9.040 -3.705 451 HB2 GLU 59 HB2 GLU 59 7.358 9.981 -0.906 452 HB3 GLU 59 HB1 GLU 59 8.735 9.410 -1.819 453 HG2 GLU 59 HG2 GLU 59 7.062 11.801 -2.522 454 HG3 GLU 59 HG1 GLU 59 8.599 11.872 -1.683 455 H MET 60 HN MET 60 4.877 8.429 -1.256 456 HA MET 60 HA MET 60 5.662 5.804 -0.595 457 HB2 MET 60 HB2 MET 60 2.861 6.807 -0.879 458 HB3 MET 60 HB1 MET 60 3.333 5.363 -0.032 459 HG2 MET 60 HG2 MET 60 4.770 7.381 1.176 460 HG3 MET 60 HG1 MET 60 3.189 8.081 0.897 461 HE1 MET 60 HE1 MET 60 0.859 5.456 2.631 462 HE2 MET 60 HE2 MET 60 1.372 5.512 0.943 463 HE3 MET 60 HE3 MET 60 0.908 6.999 1.771 464 H ILE 61 HN ILE 61 3.553 7.115 -3.050 465 HA ILE 61 HA ILE 61 2.954 4.827 -4.522 466 HB ILE 61 HB ILE 61 3.222 7.706 -5.352 467 HG12 ILE 61 HG12 ILE 61 1.108 5.986 -4.133 468 HG13 ILE 61 HG11 ILE 61 1.601 7.619 -3.707 469 HG21 ILE 61 HG21 ILE 61 1.818 7.175 -7.252 470 HG22 ILE 61 HG22 ILE 61 1.829 5.467 -6.808 471 HG23 ILE 61 HG23 ILE 61 3.321 6.255 -7.323 472 HD11 ILE 61 HD11 ILE 61 -0.045 6.764 -6.042 473 HD12 ILE 61 HD12 ILE 61 0.529 8.410 -5.777 474 HD13 ILE 61 HD13 ILE 61 -0.582 7.668 -4.625 475 H ASP 62 HN ASP 62 5.670 7.067 -4.675 476 HA ASP 62 HA ASP 62 6.950 6.231 -6.978 477 HB2 ASP 62 HB2 ASP 62 7.619 8.215 -5.772 478 HB3 ASP 62 HB1 ASP 62 8.139 7.242 -4.399 479 H GLU 63 HN GLU 63 6.901 4.673 -3.845 480 HA GLU 63 HA GLU 63 9.039 2.943 -3.910 481 HB2 GLU 63 HB2 GLU 63 7.423 3.100 -2.090 482 HB3 GLU 63 HB1 GLU 63 6.235 2.316 -3.112 483 HG2 GLU 63 HG2 GLU 63 7.246 0.794 -1.507 484 HG3 GLU 63 HG1 GLU 63 7.538 0.312 -3.173 485 H VAL 64 HN VAL 64 5.895 2.530 -5.303 486 HA VAL 64 HA VAL 64 6.558 -0.069 -6.439 487 HB VAL 64 HB VAL 64 4.152 -0.296 -6.701 488 HG11 VAL 64 HG11 VAL 64 4.988 -0.733 -4.454 489 HG12 VAL 64 HG12 VAL 64 3.406 0.027 -4.364 490 HG13 VAL 64 HG13 VAL 64 4.861 0.970 -4.054 491 HG21 VAL 64 HG21 VAL 64 4.205 2.424 -7.012 492 HG22 VAL 64 HG22 VAL 64 3.462 2.234 -5.429 493 HG23 VAL 64 HG23 VAL 64 2.747 1.468 -6.827 494 H ASP 65 HN ASP 65 6.198 3.178 -7.252 495 HA ASP 65 HA ASP 65 4.945 2.855 -9.792 496 HB2 ASP 65 HB2 ASP 65 4.596 4.798 -8.302 497 HB3 ASP 65 HB1 ASP 65 6.269 5.259 -8.538 498 H GLU 66 HN GLU 66 6.662 1.347 -10.614 499 HA GLU 66 HA GLU 66 9.216 2.471 -11.209 500 HB2 GLU 66 HB2 GLU 66 7.893 -0.114 -11.971 501 HB3 GLU 66 HB1 GLU 66 9.525 0.307 -12.361 502 HG2 GLU 66 HG2 GLU 66 10.140 0.389 -10.051 503 HG3 GLU 66 HG1 GLU 66 8.470 0.083 -9.603 504 H ASP 67 HN ASP 67 6.150 2.048 -12.799 505 HA ASP 67 HA ASP 67 7.186 2.619 -15.430 506 HB2 ASP 67 HB2 ASP 67 4.532 1.951 -14.266 507 HB3 ASP 67 HB1 ASP 67 4.563 2.789 -15.809 508 H GLY 68 HN GLY 68 6.451 4.498 -12.786 509 HA2 GLY 68 HA2 GLY 68 6.478 6.775 -12.515 510 HA3 GLY 68 HA1 GLY 68 6.874 6.918 -14.219 511 H SER 69 HN SER 69 4.012 5.448 -12.790 512 HA SER 69 HA SER 69 2.298 7.008 -14.478 513 HB2 SER 69 HB2 SER 69 1.648 4.983 -12.333 514 HB3 SER 69 HB1 SER 69 0.593 5.533 -13.620 515 HG SER 69 HG SER 69 2.532 3.626 -13.660 516 H GLY 70 HN GLY 70 3.417 7.082 -11.189 517 HA2 GLY 70 HA2 GLY 70 3.139 8.797 -9.622 518 HA3 GLY 70 HA1 GLY 70 1.994 9.563 -10.705 519 H THR 71 HN THR 71 0.927 6.583 -10.694 520 HA THR 71 HA THR 71 -0.677 6.830 -8.242 521 HB THR 71 HB THR 71 -2.490 5.680 -9.595 522 HG1 THR 71 HG1 THR 71 -1.216 4.993 -11.333 523 HG21 THR 71 HG21 THR 71 -3.316 7.717 -10.656 524 HG22 THR 71 HG22 THR 71 -1.710 8.445 -10.525 525 HG23 THR 71 HG23 THR 71 -2.631 8.077 -9.070 526 H VAL 72 HN VAL 72 -1.036 4.889 -7.119 527 HA VAL 72 HA VAL 72 0.357 2.512 -8.032 528 HB VAL 72 HB VAL 72 -1.240 3.201 -5.589 529 HG11 VAL 72 HG11 VAL 72 -0.822 1.048 -4.719 530 HG12 VAL 72 HG12 VAL 72 0.166 0.623 -6.123 531 HG13 VAL 72 HG13 VAL 72 -1.565 0.861 -6.313 532 HG21 VAL 72 HG21 VAL 72 0.695 3.594 -4.611 533 HG22 VAL 72 HG22 VAL 72 1.267 3.844 -6.246 534 HG23 VAL 72 HG23 VAL 72 1.539 2.295 -5.429 535 H ASP 73 HN ASP 73 -0.561 0.882 -9.138 536 HA ASP 73 HA ASP 73 -3.518 0.725 -9.005 537 HB2 ASP 73 HB2 ASP 73 -3.578 -0.439 -11.044 538 HB3 ASP 73 HB1 ASP 73 -2.508 0.903 -11.323 539 H PHE 74 HN PHE 74 -4.007 -1.895 -9.490 540 HA PHE 74 HA PHE 74 -4.044 -2.553 -6.839 541 HB2 PHE 74 HB2 PHE 74 -5.704 -3.458 -8.234 542 HB3 PHE 74 HB1 PHE 74 -4.521 -4.274 -9.247 543 HD1 PHE 74 HD1 PHE 74 -5.168 -6.467 -9.094 544 HD2 PHE 74 HD2 PHE 74 -4.644 -4.204 -5.534 545 HE1 PHE 74 HE1 PHE 74 -5.371 -8.517 -7.768 546 HE2 PHE 74 HE2 PHE 74 -4.834 -6.260 -4.197 547 HZ PHE 74 HZ PHE 74 -5.210 -8.417 -5.318 548 H ASP 75 HN ASP 75 -1.823 -4.114 -9.234 549 HA ASP 75 HA ASP 75 -0.761 -5.816 -7.221 550 HB2 ASP 75 HB2 ASP 75 -0.363 -6.791 -9.181 551 HB3 ASP 75 HB1 ASP 75 -0.162 -5.263 -10.012 552 H GLU 76 HN GLU 76 0.058 -2.661 -8.412 553 HA GLU 76 HA GLU 76 2.524 -2.417 -7.135 554 HB2 GLU 76 HB2 GLU 76 0.525 -0.300 -7.665 555 HB3 GLU 76 HB1 GLU 76 2.196 -0.070 -7.374 556 HG2 GLU 76 HG2 GLU 76 2.636 -1.348 -9.483 557 HG3 GLU 76 HG1 GLU 76 0.905 -1.237 -9.769 558 H PHE 77 HN PHE 77 -0.702 -1.380 -6.146 559 HA PHE 77 HA PHE 77 -0.331 -0.802 -3.471 560 HB2 PHE 77 HB2 PHE 77 -2.576 -0.640 -4.619 561 HB3 PHE 77 HB1 PHE 77 -2.705 -2.394 -4.539 562 HD1 PHE 77 HD1 PHE 77 -2.326 0.620 -2.392 563 HD2 PHE 77 HD2 PHE 77 -3.664 -3.414 -2.642 564 HE1 PHE 77 HE1 PHE 77 -3.272 0.799 -0.136 565 HE2 PHE 77 HE2 PHE 77 -4.613 -3.232 -0.373 566 HZ PHE 77 HZ PHE 77 -4.411 -1.118 0.888 567 H LEU 78 HN LEU 78 -1.157 -3.912 -4.838 568 HA LEU 78 HA LEU 78 -1.341 -5.350 -2.498 569 HB2 LEU 78 HB2 LEU 78 -2.363 -6.090 -4.474 570 HB3 LEU 78 HB1 LEU 78 -0.837 -6.087 -5.316 571 HG LEU 78 HG LEU 78 -0.136 -8.078 -4.342 572 HD11 LEU 78 HD11 LEU 78 -0.711 -7.535 -2.027 573 HD12 LEU 78 HD12 LEU 78 -1.259 -9.150 -2.533 574 HD13 LEU 78 HD13 LEU 78 -2.410 -7.809 -2.434 575 HD21 LEU 78 HD21 LEU 78 -3.083 -8.350 -4.470 576 HD22 LEU 78 HD22 LEU 78 -1.869 -9.598 -4.734 577 HD23 LEU 78 HD23 LEU 78 -2.055 -8.277 -5.895 578 H VAL 79 HN VAL 79 1.483 -5.222 -4.710 579 HA VAL 79 HA VAL 79 2.960 -7.132 -3.235 580 HB VAL 79 HB VAL 79 3.583 -6.425 -5.571 581 HG11 VAL 79 HG11 VAL 79 3.298 -3.977 -5.061 582 HG12 VAL 79 HG12 VAL 79 4.809 -4.392 -5.882 583 HG13 VAL 79 HG13 VAL 79 4.800 -4.087 -4.135 584 HG21 VAL 79 HG21 VAL 79 5.975 -6.461 -5.194 585 HG22 VAL 79 HG22 VAL 79 5.163 -7.614 -4.138 586 HG23 VAL 79 HG23 VAL 79 5.723 -6.069 -3.502 587 H MET 80 HN MET 80 2.631 -3.611 -2.977 588 HA MET 80 HA MET 80 4.684 -3.375 -1.022 589 HB2 MET 80 HB2 MET 80 4.046 -1.392 -2.312 590 HB3 MET 80 HB1 MET 80 2.411 -1.477 -1.672 591 HG2 MET 80 HG2 MET 80 3.713 0.255 -0.557 592 HG3 MET 80 HG1 MET 80 3.236 -1.009 0.570 593 HE1 MET 80 HE1 MET 80 4.965 -1.564 2.435 594 HE2 MET 80 HE2 MET 80 4.991 0.181 2.200 595 HE3 MET 80 HE3 MET 80 6.504 -0.702 2.395 596 H MET 81 HN MET 81 1.327 -4.158 -1.078 597 HA MET 81 HA MET 81 0.716 -3.944 1.651 598 HB2 MET 81 HB2 MET 81 -0.889 -4.391 -0.206 599 HB3 MET 81 HB1 MET 81 -0.319 -6.031 -0.258 600 HG2 MET 81 HG2 MET 81 -2.477 -5.387 1.037 601 HG3 MET 81 HG1 MET 81 -1.367 -6.611 1.645 602 HE1 MET 81 HE1 MET 81 -0.660 -2.633 1.791 603 HE2 MET 81 HE2 MET 81 -1.585 -2.249 3.239 604 HE3 MET 81 HE3 MET 81 -2.409 -2.836 1.794 605 H VAL 82 HN VAL 82 1.736 -6.906 -0.136 606 HA VAL 82 HA VAL 82 2.162 -8.355 2.260 607 HB VAL 82 HB VAL 82 2.020 -9.532 0.099 608 HG11 VAL 82 HG11 VAL 82 3.790 -9.518 -1.490 609 HG12 VAL 82 HG12 VAL 82 4.812 -8.555 -0.429 610 HG13 VAL 82 HG13 VAL 82 3.374 -7.843 -1.160 611 HG21 VAL 82 HG21 VAL 82 3.771 -11.165 0.514 612 HG22 VAL 82 HG22 VAL 82 3.077 -10.618 2.038 613 HG23 VAL 82 HG23 VAL 82 4.644 -9.997 1.508 614 H ARG 83 HN ARG 83 4.094 -6.092 0.471 615 HA ARG 83 HA ARG 83 6.535 -6.541 1.786 616 HB2 ARG 83 HB2 ARG 83 6.214 -5.314 -0.344 617 HB3 ARG 83 HB1 ARG 83 5.538 -3.983 0.571 618 HG2 ARG 83 HG2 ARG 83 7.682 -3.775 1.779 619 HG3 ARG 83 HG1 ARG 83 8.333 -5.059 0.770 620 HD2 ARG 83 HD2 ARG 83 7.869 -3.693 -1.232 621 HD3 ARG 83 HD1 ARG 83 7.319 -2.389 -0.174 622 HE ARG 83 HE ARG 83 10.090 -3.452 -0.234 623 HH11 ARG 83 HH11 ARG 83 7.813 -0.824 0.287 624 HH12 ARG 83 HH12 ARG 83 9.059 0.368 0.470 625 HH21 ARG 83 HH21 ARG 83 11.699 -1.895 0.130 626 HH22 ARG 83 HH22 ARG 83 11.265 -0.239 0.413 627 H SER 84 HN SER 84 3.924 -4.213 2.471 628 HA SER 84 HA SER 84 5.132 -2.899 4.633 629 HB2 SER 84 HB2 SER 84 3.176 -1.995 3.450 630 HB3 SER 84 HB1 SER 84 2.186 -3.320 4.049 631 HG SER 84 HG SER 84 2.294 -1.108 5.179 632 H MET 85 HN MET 85 3.157 -5.806 4.517 633 HA MET 85 HA MET 85 2.932 -5.979 7.385 634 HB2 MET 85 HB2 MET 85 1.663 -8.006 6.954 635 HB3 MET 85 HB1 MET 85 1.104 -6.705 5.918 636 HG2 MET 85 HG2 MET 85 2.552 -7.641 4.137 637 HG3 MET 85 HG1 MET 85 2.849 -9.026 5.172 638 HE1 MET 85 HE1 MET 85 -0.423 -6.912 4.596 639 HE2 MET 85 HE2 MET 85 -1.280 -7.912 3.426 640 HE3 MET 85 HE3 MET 85 0.217 -7.101 2.961 641 H LYS 86 HN LYS 86 5.069 -7.212 4.955 642 HA LYS 86 HA LYS 86 5.989 -9.439 6.511 643 HB2 LYS 86 HB2 LYS 86 6.810 -8.205 3.941 644 HB3 LYS 86 HB1 LYS 86 7.828 -9.411 4.694 645 HG2 LYS 86 HG2 LYS 86 4.934 -9.822 3.998 646 HG3 LYS 86 HG1 LYS 86 6.275 -10.276 2.952 647 HD2 LYS 86 HD2 LYS 86 7.129 -11.708 4.816 648 HD3 LYS 86 HD1 LYS 86 5.631 -11.356 5.685 649 HE2 LYS 86 HE2 LYS 86 4.343 -12.277 3.825 650 HE3 LYS 86 HE1 LYS 86 5.841 -12.637 2.968 651 HZ1 LYS 86 HZ1 LYS 86 4.948 -14.581 4.099 652 HZ2 LYS 86 HZ2 LYS 86 5.053 -13.788 5.587 653 HZ3 LYS 86 HZ3 LYS 86 6.461 -14.154 4.722 654 H ASP 87 HN ASP 87 7.437 -6.408 5.424 655 HA ASP 87 HA ASP 87 9.717 -5.809 5.855 656 HB2 ASP 87 HB2 ASP 87 8.110 -4.108 6.532 657 HB3 ASP 87 HB1 ASP 87 7.986 -4.844 8.129 658 H ASP 88 HN ASP 88 11.213 -7.291 6.319 659 HA ASP 88 HA ASP 88 11.353 -8.916 8.589 660 HB2 ASP 88 HB2 ASP 88 13.590 -7.890 6.838 661 HB3 ASP 88 HB1 ASP 88 13.748 -9.195 8.005 662 H SER 89 HN SER 89 12.052 -5.612 8.166 663 HA SER 89 HA SER 89 12.957 -3.981 9.435 664 HB2 SER 89 HB2 SER 89 12.787 -5.972 11.716 665 HB3 SER 89 HB1 SER 89 12.947 -4.223 11.861 666 HG SER 89 HG SER 89 10.853 -4.593 10.337 667 H LYS 90 HN LYS 90 14.673 -5.065 7.880 668 HA LYS 90 HA LYS 90 16.784 -6.566 8.938 669 HB2 LYS 90 HB2 LYS 90 16.788 -4.702 6.574 670 HB3 LYS 90 HB1 LYS 90 18.005 -5.925 6.908 671 HG2 LYS 90 HG2 LYS 90 16.294 -7.662 6.714 672 HG3 LYS 90 HG1 LYS 90 15.095 -6.433 6.330 673 HD2 LYS 90 HD2 LYS 90 17.592 -6.686 4.693 674 HD3 LYS 90 HD1 LYS 90 16.231 -7.768 4.409 675 HE2 LYS 90 HE2 LYS 90 15.977 -5.982 2.886 676 HE3 LYS 90 HE1 LYS 90 14.800 -5.701 4.162 677 HZ1 LYS 90 HZ1 LYS 90 17.456 -4.389 4.066 678 HZ2 LYS 90 HZ2 LYS 90 16.167 -4.018 5.094 679 HZ3 LYS 90 HZ3 LYS 90 16.047 -3.703 3.439 680 H GLY 136 HN GLY 136 17.959 -5.936 10.619 681 HA2 GLY 136 HA2 GLY 136 19.524 -4.720 11.803 682 HA3 GLY 136 HA1 GLY 136 19.622 -3.605 10.447 683 H LYS 137 HN LYS 137 16.459 -4.073 11.361 684 HA LYS 137 HA LYS 137 14.865 -2.683 12.176 685 HB2 LYS 137 HB2 LYS 137 16.201 -3.379 14.284 686 HB3 LYS 137 HB1 LYS 137 16.848 -1.741 14.221 687 HG2 LYS 137 HG2 LYS 137 14.929 -1.983 15.766 688 HG3 LYS 137 HG1 LYS 137 14.649 -0.804 14.485 689 HD2 LYS 137 HD2 LYS 137 13.314 -2.402 13.251 690 HD3 LYS 137 HD1 LYS 137 13.679 -3.661 14.429 691 HE2 LYS 137 HE2 LYS 137 12.199 -1.107 15.036 692 HE3 LYS 137 HE1 LYS 137 11.429 -2.654 14.702 693 HZ1 LYS 137 HZ1 LYS 137 11.579 -2.264 17.065 694 HZ2 LYS 137 HZ2 LYS 137 13.257 -2.079 16.968 695 HZ3 LYS 137 HZ3 LYS 137 12.553 -3.579 16.641 696 H PHE 138 HN PHE 138 16.696 -1.655 10.159 697 HA PHE 138 HA PHE 138 16.131 1.138 10.422 698 HB2 PHE 138 HB2 PHE 138 18.131 0.968 11.814 699 HB3 PHE 138 HB1 PHE 138 19.003 0.195 10.500 700 HD1 PHE 138 HD1 PHE 138 20.052 1.493 8.815 701 HD2 PHE 138 HD2 PHE 138 17.389 3.317 11.579 702 HE1 PHE 138 HE1 PHE 138 20.759 3.714 8.019 703 HE2 PHE 138 HE2 PHE 138 18.086 5.544 10.790 704 HZ PHE 138 HZ PHE 138 19.772 5.741 9.007 705 H LYS 139 HN LYS 139 15.198 1.242 8.469 706 HA LYS 139 HA LYS 139 16.875 0.603 6.142 707 HB2 LYS 139 HB2 LYS 139 14.826 0.998 4.798 708 HB3 LYS 139 HB1 LYS 139 14.621 -0.290 5.973 709 HG2 LYS 139 HG2 LYS 139 13.344 1.141 7.409 710 HG3 LYS 139 HG1 LYS 139 13.671 2.536 6.378 711 HD2 LYS 139 HD2 LYS 139 11.431 1.681 5.973 712 HD3 LYS 139 HD1 LYS 139 12.443 1.450 4.549 713 HE2 LYS 139 HE2 LYS 139 11.083 -0.520 4.958 714 HE3 LYS 139 HE1 LYS 139 12.790 -0.892 5.180 715 HZ1 LYS 139 HZ1 LYS 139 11.330 -1.844 6.912 716 HZ2 LYS 139 HZ2 LYS 139 10.919 -0.274 7.396 717 HZ3 LYS 139 HZ3 LYS 139 12.513 -0.806 7.542 718 H ARG 140 HN ARG 140 17.426 2.243 4.677 719 HA ARG 140 HA ARG 140 18.122 4.631 5.937 720 HB2 ARG 140 HB2 ARG 140 18.652 5.439 3.561 721 HB3 ARG 140 HB1 ARG 140 19.539 4.070 4.197 722 HG2 ARG 140 HG2 ARG 140 19.073 3.367 2.066 723 HG3 ARG 140 HG1 ARG 140 17.724 2.667 2.959 724 HD2 ARG 140 HD2 ARG 140 16.268 4.463 2.261 725 HD3 ARG 140 HD1 ARG 140 17.614 5.296 1.480 726 HE ARG 140 HE ARG 140 16.964 2.603 0.547 727 HH11 ARG 140 HH11 ARG 140 16.780 6.065 -0.001 728 HH12 ARG 140 HH12 ARG 140 16.410 5.900 -1.688 729 HH21 ARG 140 HH21 ARG 140 16.482 2.396 -1.671 730 HH22 ARG 140 HH22 ARG 140 16.244 3.818 -2.637 731 HA PRO 141 HA PRO 141 14.553 7.064 5.720 732 HB2 PRO 141 HB2 PRO 141 16.331 9.348 6.209 733 HB3 PRO 141 HB1 PRO 141 15.171 8.591 7.298 734 HG2 PRO 141 HG2 PRO 141 17.794 8.333 7.733 735 HG3 PRO 141 HG1 PRO 141 16.679 6.995 8.034 736 HD2 PRO 141 HD2 PRO 141 18.346 7.560 5.606 737 HD3 PRO 141 HD1 PRO 141 18.284 6.106 6.605 738 H THR 142 HN THR 142 13.518 7.852 4.034 739 HA THR 142 HA THR 142 14.986 9.515 2.120 740 HB THR 142 HB THR 142 12.909 7.514 1.268 741 HG1 THR 142 HG1 THR 142 15.694 7.201 1.690 742 HG21 THR 142 HG21 THR 142 13.415 9.347 -0.287 743 HG22 THR 142 HG22 THR 142 13.954 7.793 -0.923 744 HG23 THR 142 HG23 THR 142 15.123 8.917 -0.234 745 H LEU 143 HN LEU 143 11.966 8.528 3.551 746 HA LEU 143 HA LEU 143 10.576 10.892 3.366 747 HB2 LEU 143 HB2 LEU 143 10.882 9.551 0.825 748 HB3 LEU 143 HB1 LEU 143 9.192 9.684 1.279 749 HG LEU 143 HG LEU 143 10.844 12.128 1.589 750 HD11 LEU 143 HD11 LEU 143 10.369 12.665 -0.793 751 HD12 LEU 143 HD12 LEU 143 10.007 10.954 -1.021 752 HD13 LEU 143 HD13 LEU 143 11.625 11.455 -0.525 753 HD21 LEU 143 HD21 LEU 143 8.474 12.095 2.192 754 HD22 LEU 143 HD22 LEU 143 8.071 11.604 0.545 755 HD23 LEU 143 HD23 LEU 143 8.787 13.189 0.842 756 H ARG 144 HN ARG 144 8.078 10.200 2.816 757 HA ARG 144 HA ARG 144 6.268 9.385 3.882 758 HB2 ARG 144 HB2 ARG 144 5.932 6.970 3.675 759 HB3 ARG 144 HB1 ARG 144 6.617 7.633 2.206 760 HG2 ARG 144 HG2 ARG 144 8.855 6.808 2.993 761 HG3 ARG 144 HG1 ARG 144 8.010 5.983 4.301 762 HD2 ARG 144 HD2 ARG 144 8.222 4.336 2.688 763 HD3 ARG 144 HD1 ARG 144 6.586 4.940 2.437 764 HE ARG 144 HE ARG 144 7.694 6.356 0.617 765 HH11 ARG 144 HH11 ARG 144 8.887 3.219 1.579 766 HH12 ARG 144 HH12 ARG 144 9.438 2.790 -0.015 767 HH21 ARG 144 HH21 ARG 144 8.464 5.812 -1.485 768 HH22 ARG 144 HH22 ARG 144 9.238 4.278 -1.730 769 H ARG 145 HN ARG 145 6.990 10.453 5.776 770 HA ARG 145 HA ARG 145 8.224 8.948 7.899 771 HB2 ARG 145 HB2 ARG 145 6.783 11.610 7.893 772 HB3 ARG 145 HB1 ARG 145 7.624 10.942 9.284 773 HG2 ARG 145 HG2 ARG 145 9.045 12.562 8.248 774 HG3 ARG 145 HG1 ARG 145 9.722 10.962 7.949 775 HD2 ARG 145 HD2 ARG 145 8.717 10.958 5.740 776 HD3 ARG 145 HD1 ARG 145 8.064 12.569 6.028 777 HE ARG 145 HE ARG 145 10.969 12.135 6.140 778 HH11 ARG 145 HH11 ARG 145 8.186 13.624 4.640 779 HH12 ARG 145 HH12 ARG 145 9.128 14.669 3.627 780 HH21 ARG 145 HH21 ARG 145 12.219 13.511 4.810 781 HH22 ARG 145 HH22 ARG 145 11.417 14.605 3.724 782 H VAL 146 HN VAL 146 5.209 9.712 6.645 783 HA VAL 146 HA VAL 146 3.602 8.713 8.810 784 HB VAL 146 HB VAL 146 1.759 9.044 7.091 785 HG11 VAL 146 HG11 VAL 146 1.767 11.440 7.268 786 HG12 VAL 146 HG12 VAL 146 3.486 11.419 7.696 787 HG13 VAL 146 HG13 VAL 146 2.295 10.705 8.787 788 HG21 VAL 146 HG21 VAL 146 3.443 8.862 5.160 789 HG22 VAL 146 HG22 VAL 146 3.849 10.544 5.528 790 HG23 VAL 146 HG23 VAL 146 2.215 10.117 5.039 791 H ARG 147 HN ARG 147 3.981 6.564 9.109 792 HA ARG 147 HA ARG 147 4.181 4.812 6.788 793 HB2 ARG 147 HB2 ARG 147 5.916 4.520 8.385 794 HB3 ARG 147 HB1 ARG 147 4.773 4.464 9.717 795 HG2 ARG 147 HG2 ARG 147 5.728 2.269 9.184 796 HG3 ARG 147 HG1 ARG 147 3.976 2.312 9.019 797 HD2 ARG 147 HD2 ARG 147 4.043 1.970 6.783 798 HD3 ARG 147 HD1 ARG 147 5.528 2.886 6.568 799 HE ARG 147 HE ARG 147 6.767 0.960 6.999 800 HH11 ARG 147 HH11 ARG 147 3.342 0.341 7.414 801 HH12 ARG 147 HH12 ARG 147 3.538 -1.382 7.480 802 HH21 ARG 147 HH21 ARG 147 7.012 -1.310 7.098 803 HH22 ARG 147 HH22 ARG 147 5.618 -2.319 7.313 804 H ILE 148 HN ILE 148 2.256 4.123 6.029 805 HA ILE 148 HA ILE 148 0.001 3.587 7.690 806 HB ILE 148 HB ILE 148 0.535 3.657 4.884 807 HG12 ILE 148 HG12 ILE 148 -2.063 3.408 6.409 808 HG13 ILE 148 HG11 ILE 148 -1.214 4.905 6.082 809 HG21 ILE 148 HG21 ILE 148 0.555 1.236 4.844 810 HG22 ILE 148 HG22 ILE 148 -0.944 1.828 4.115 811 HG23 ILE 148 HG23 ILE 148 -0.951 1.183 5.758 812 HD11 ILE 148 HD11 ILE 148 -2.083 3.086 3.888 813 HD12 ILE 148 HD12 ILE 148 -1.607 4.780 3.791 814 HD13 ILE 148 HD13 ILE 148 -3.140 4.335 4.547 815 H SER 149 HN SER 149 -0.380 1.826 8.901 816 HA SER 149 HA SER 149 1.341 -0.475 8.723 817 HB2 SER 149 HB2 SER 149 -1.207 -0.141 10.308 818 HB3 SER 149 HB1 SER 149 -0.005 -1.404 10.526 819 HG SER 149 HG SER 149 0.827 1.270 10.688 820 H ALA 150 HN ALA 150 0.932 -2.369 7.661 821 HA ALA 150 HA ALA 150 -0.651 -2.304 5.410 822 HB1 ALA 150 HB1 ALA 150 0.195 -4.781 6.896 823 HB2 ALA 150 HB2 ALA 150 1.219 -3.853 5.802 824 HB3 ALA 150 HB3 ALA 150 -0.221 -4.663 5.186 825 H ASP 151 HN ASP 151 -1.337 -4.286 8.275 826 HA ASP 151 HA ASP 151 -3.959 -5.013 7.441 827 HB2 ASP 151 HB2 ASP 151 -2.558 -5.167 10.103 828 HB3 ASP 151 HB1 ASP 151 -4.152 -5.842 9.793 829 H ALA 152 HN ALA 152 -2.738 -2.594 9.744 830 HA ALA 152 HA ALA 152 -5.278 -1.892 10.743 831 HB1 ALA 152 HB1 ALA 152 -2.879 -1.288 11.611 832 HB2 ALA 152 HB2 ALA 152 -4.259 -0.244 11.929 833 HB3 ALA 152 HB3 ALA 152 -3.135 0.164 10.636 834 H MET 153 HN MET 153 -3.322 -0.628 8.099 835 HA MET 153 HA MET 153 -5.144 1.361 7.252 836 HB2 MET 153 HB2 MET 153 -2.957 1.465 6.319 837 HB3 MET 153 HB1 MET 153 -3.039 -0.210 5.780 838 HG2 MET 153 HG2 MET 153 -5.182 1.462 4.718 839 HG3 MET 153 HG1 MET 153 -3.563 1.963 4.234 840 HE1 MET 153 HE1 MET 153 -2.459 1.165 2.353 841 HE2 MET 153 HE2 MET 153 -2.367 -0.510 1.807 842 HE3 MET 153 HE3 MET 153 -1.750 -0.066 3.403 843 H MET 154 HN MET 154 -4.512 -1.930 6.174 844 HA MET 154 HA MET 154 -6.477 -2.307 4.329 845 HB2 MET 154 HB2 MET 154 -5.096 -4.044 6.263 846 HB3 MET 154 HB1 MET 154 -6.564 -4.693 5.601 847 HG2 MET 154 HG2 MET 154 -5.687 -4.461 3.353 848 HG3 MET 154 HG1 MET 154 -4.216 -3.728 4.001 849 HE1 MET 154 HE1 MET 154 -5.486 -8.064 4.904 850 HE2 MET 154 HE2 MET 154 -6.384 -6.998 3.822 851 HE3 MET 154 HE3 MET 154 -6.297 -6.634 5.547 852 H GLN 155 HN GLN 155 -6.803 -2.551 7.864 853 HA GLN 155 HA GLN 155 -9.472 -3.549 7.771 854 HB2 GLN 155 HB2 GLN 155 -7.692 -3.579 9.705 855 HB3 GLN 155 HB1 GLN 155 -8.447 -2.053 10.131 856 HG2 GLN 155 HG2 GLN 155 -10.651 -3.266 10.060 857 HG3 GLN 155 HG1 GLN 155 -9.723 -4.752 9.982 858 HE21 GLN 155 HE21 GLN 155 -8.657 -5.508 11.790 859 HE22 GLN 155 HE22 GLN 155 -8.857 -4.811 13.360 860 H ALA 156 HN ALA 156 -8.064 -0.373 7.662 861 HA ALA 156 HA ALA 156 -10.344 1.111 8.404 862 HB1 ALA 156 HB1 ALA 156 -8.141 1.868 6.504 863 HB2 ALA 156 HB2 ALA 156 -8.154 2.119 8.252 864 HB3 ALA 156 HB3 ALA 156 -9.306 2.972 7.229 865 H LEU 157 HN LEU 157 -9.167 -0.121 5.282 866 HA LEU 157 HA LEU 157 -11.567 0.752 3.939 867 HB2 LEU 157 HB2 LEU 157 -9.577 -1.195 2.957 868 HB3 LEU 157 HB1 LEU 157 -10.815 -0.473 2.047 869 HG LEU 157 HG LEU 157 -9.084 0.768 1.320 870 HD11 LEU 157 HD11 LEU 157 -10.630 2.185 2.956 871 HD12 LEU 157 HD12 LEU 157 -9.268 2.837 2.051 872 HD13 LEU 157 HD13 LEU 157 -9.054 2.388 3.745 873 HD21 LEU 157 HD21 LEU 157 -7.527 -0.526 2.748 874 HD22 LEU 157 HD22 LEU 157 -7.758 0.723 3.969 875 HD23 LEU 157 HD23 LEU 157 -7.080 1.142 2.389 876 H LEU 158 HN LEU 158 -10.284 -2.198 5.280 877 HA LEU 158 HA LEU 158 -11.832 -3.993 3.784 878 HB2 LEU 158 HB2 LEU 158 -9.814 -4.144 5.722 879 HB3 LEU 158 HB1 LEU 158 -11.119 -5.118 6.295 880 HG LEU 158 HG LEU 158 -11.003 -6.135 3.919 881 HD11 LEU 158 HD11 LEU 158 -9.416 -4.459 3.161 882 HD12 LEU 158 HD12 LEU 158 -8.789 -6.106 3.039 883 HD13 LEU 158 HD13 LEU 158 -8.275 -5.056 4.368 884 HD21 LEU 158 HD21 LEU 158 -9.037 -6.602 6.133 885 HD22 LEU 158 HD22 LEU 158 -9.228 -7.687 4.759 886 HD23 LEU 158 HD23 LEU 158 -10.571 -7.439 5.876 887 H GLY 159 HN GLY 159 -13.269 -1.911 5.751 888 HA2 GLY 159 HA2 GLY 159 -14.790 -3.265 7.604 889 HA3 GLY 159 HA1 GLY 159 -15.392 -1.920 6.654 890 H ALA 160 HN ALA 160 -14.857 -3.611 4.218 891 HA ALA 160 HA ALA 160 -17.338 -4.812 3.797 892 HB1 ALA 160 HB1 ALA 160 -15.810 -3.950 2.080 893 HB2 ALA 160 HB2 ALA 160 -16.326 -5.605 1.746 894 HB3 ALA 160 HB3 ALA 160 -14.712 -5.296 2.398 895 H ARG 161 HN ARG 161 -14.204 -6.259 4.797 896 HA ARG 161 HA ARG 161 -15.618 -8.774 5.355 897 HB2 ARG 161 HB2 ARG 161 -13.872 -10.088 4.263 898 HB3 ARG 161 HB1 ARG 161 -14.629 -9.007 3.111 899 HG2 ARG 161 HG2 ARG 161 -12.766 -7.469 3.290 900 HG3 ARG 161 HG1 ARG 161 -12.002 -8.533 4.475 901 HD2 ARG 161 HD2 ARG 161 -10.992 -9.030 2.411 902 HD3 ARG 161 HD1 ARG 161 -12.126 -10.336 2.748 903 HE ARG 161 HE ARG 161 -13.279 -8.277 1.138 904 HH11 ARG 161 HH11 ARG 161 -11.370 -11.209 1.109 905 HH12 ARG 161 HH12 ARG 161 -11.619 -11.503 -0.583 906 HH21 ARG 161 HH21 ARG 161 -13.642 -8.689 -1.080 907 HH22 ARG 161 HH22 ARG 161 -12.916 -10.081 -1.822 908 H ALA 162 HN ALA 162 -13.595 -6.430 6.551 909 HA ALA 162 HA ALA 162 -11.502 -7.869 7.819 910 HB1 ALA 162 HB1 ALA 162 -10.940 -5.702 7.996 911 HB2 ALA 162 HB2 ALA 162 -11.897 -5.749 9.476 912 HB3 ALA 162 HB3 ALA 162 -12.616 -5.164 7.975 913 H LYS 163 HN LYS 163 -14.821 -7.415 8.506 914 HA LYS 163 HA LYS 163 -14.499 -7.955 11.334 915 HB2 LYS 163 HB2 LYS 163 -16.283 -6.390 9.786 916 HB3 LYS 163 HB1 LYS 163 -17.200 -7.552 10.725 917 HG2 LYS 163 HG2 LYS 163 -15.093 -5.810 11.953 918 HG3 LYS 163 HG1 LYS 163 -16.761 -5.273 11.769 919 HD2 LYS 163 HD2 LYS 163 -16.540 -6.140 13.975 920 HD3 LYS 163 HD1 LYS 163 -17.460 -7.319 13.045 921 HE2 LYS 163 HE2 LYS 163 -15.502 -8.711 12.797 922 HE3 LYS 163 HE1 LYS 163 -14.498 -7.495 13.589 923 HZ1 LYS 163 HZ1 LYS 163 -15.102 -9.291 15.088 924 HZ2 LYS 163 HZ2 LYS 163 -16.743 -8.971 14.849 925 HZ3 LYS 163 HZ3 LYS 163 -15.761 -7.827 15.612 926 H GLY 164 HN GLY 164 -14.301 -10.047 11.710 927 HA2 GLY 164 HA2 GLY 164 -16.638 -11.689 11.116 928 HA3 GLY 164 HA1 GLY 164 -15.077 -12.296 10.582 929 H HIS 165 HN HIS 165 -13.889 -13.433 11.975 930 HA HIS 165 HA HIS 165 -14.910 -13.795 14.669 931 HB2 HIS 165 HB2 HIS 165 -14.193 -15.744 13.288 932 HB3 HIS 165 HB1 HIS 165 -12.546 -15.127 13.320 933 HD1 HIS 165 HD1 HIS 165 -14.853 -17.268 15.151 934 HD2 HIS 165 HD2 HIS 165 -11.408 -15.110 16.022 935 HE1 HIS 165 HE1 HIS 165 -14.004 -18.193 17.327 936 HE2 HIS 165 HE2 HIS 165 -11.901 -16.903 17.820 937 HAB 9XG 201 HAB DRG 201 2.206 2.502 3.631 938 HAC 9XG 201 HAC DRG 201 3.123 3.967 4.056 939 HAA 9XG 201 HAA DRG 201 3.720 2.367 4.559 940 HAD 9XG 201 HAD DRG 201 -1.820 3.093 -1.887 941 HAE 9XG 201 HAE DRG 201 -0.230 4.695 -2.913 942 HAF 9XG 201 HAF DRG 201 -1.010 1.469 -0.196 943 HAG 9XG 201 HAG DRG 201 7.088 2.462 1.423 944 HAH 9XG 201 HAH DRG 201 5.840 2.714 3.551 945 HAI 9XG 201 HAI DRG 201 2.218 4.311 -2.666 946 HAJ 9XG 201 HAJ DRG 201 1.418 1.301 0.291 947 HAK 9XG 201 HAK DRG 201 5.877 2.436 -0.732 948 HAL 9XG 201 HAL DRG 201 2.151 2.911 1.356 949 HAM 9XG 201 HAM DRG 201 3.812 2.395 -1.783 Start of MODEL 6 1 H1 MET 1 HT1 MET 1 7.843 -2.465 -9.875 2 H2 MET 1 HT2 MET 1 8.007 -1.604 -8.424 3 H3 MET 1 HT3 MET 1 6.498 -1.686 -9.186 4 HA MET 1 HA MET 1 6.515 -3.148 -7.319 5 HB2 MET 1 HB2 MET 1 5.267 -3.822 -9.324 6 HB3 MET 1 HB1 MET 1 6.697 -4.619 -9.963 7 HG2 MET 1 HG2 MET 1 6.626 -6.249 -8.230 8 HG3 MET 1 HG1 MET 1 5.349 -5.362 -7.403 9 HE1 MET 1 HE1 MET 1 3.152 -8.283 -8.329 10 HE2 MET 1 HE2 MET 1 3.005 -6.780 -7.423 11 HE3 MET 1 HE3 MET 1 4.437 -7.794 -7.222 12 H ASP 2 HN ASP 2 7.873 -3.978 -5.850 13 HA ASP 2 HA ASP 2 10.571 -4.677 -6.489 14 HB2 ASP 2 HB2 ASP 2 9.398 -3.930 -4.165 15 HB3 ASP 2 HB1 ASP 2 9.439 -5.672 -3.967 16 H ASP 3 HN ASP 3 11.222 -6.546 -7.372 17 HA ASP 3 HA ASP 3 9.331 -8.499 -8.014 18 HB2 ASP 3 HB2 ASP 3 12.272 -8.778 -8.147 19 HB3 ASP 3 HB1 ASP 3 11.131 -9.826 -8.930 20 H ILE 4 HN ILE 4 11.502 -8.284 -5.298 21 HA ILE 4 HA ILE 4 11.516 -10.982 -4.544 22 HB ILE 4 HB ILE 4 12.963 -9.284 -3.484 23 HG12 ILE 4 HG12 ILE 4 12.273 -11.485 -2.321 24 HG13 ILE 4 HG11 ILE 4 13.051 -10.245 -1.349 25 HG21 ILE 4 HG21 ILE 4 10.428 -8.336 -2.171 26 HG22 ILE 4 HG22 ILE 4 11.398 -7.451 -3.349 27 HG23 ILE 4 HG23 ILE 4 12.055 -7.797 -1.747 28 HD11 ILE 4 HD11 ILE 4 10.877 -9.574 -0.467 29 HD12 ILE 4 HD12 ILE 4 11.190 -11.285 -0.167 30 HD13 ILE 4 HD13 ILE 4 10.091 -10.799 -1.460 31 H TYR 5 HN TYR 5 9.339 -8.367 -3.662 32 HA TYR 5 HA TYR 5 7.529 -10.083 -2.240 33 HB2 TYR 5 HB2 TYR 5 7.546 -7.162 -2.954 34 HB3 TYR 5 HB1 TYR 5 6.180 -7.921 -2.149 35 HD1 TYR 5 HD1 TYR 5 9.191 -6.195 -1.576 36 HD2 TYR 5 HD2 TYR 5 6.852 -9.430 -0.093 37 HE1 TYR 5 HE1 TYR 5 10.329 -6.045 0.596 38 HE2 TYR 5 HE2 TYR 5 7.968 -9.273 2.058 39 HH TYR 5 HH TYR 5 9.839 -6.659 2.995 40 H LYS 6 HN LYS 6 7.946 -8.752 -5.320 41 HA LYS 6 HA LYS 6 5.535 -9.320 -6.583 42 HB2 LYS 6 HB2 LYS 6 7.696 -8.154 -7.318 43 HB3 LYS 6 HB1 LYS 6 8.252 -9.768 -7.746 44 HG2 LYS 6 HG2 LYS 6 6.367 -9.983 -9.289 45 HG3 LYS 6 HG1 LYS 6 5.876 -8.335 -8.886 46 HD2 LYS 6 HD2 LYS 6 7.842 -7.408 -9.811 47 HD3 LYS 6 HD1 LYS 6 8.626 -8.993 -9.943 48 HE2 LYS 6 HE2 LYS 6 7.049 -9.685 -11.628 49 HE3 LYS 6 HE1 LYS 6 6.088 -8.228 -11.391 50 HZ1 LYS 6 HZ1 LYS 6 8.873 -8.262 -12.418 51 HZ2 LYS 6 HZ2 LYS 6 7.853 -6.916 -12.311 52 HZ3 LYS 6 HZ3 LYS 6 7.492 -8.166 -13.388 53 H ALA 7 HN ALA 7 8.199 -11.340 -5.562 54 HA ALA 7 HA ALA 7 7.134 -13.748 -6.681 55 HB1 ALA 7 HB1 ALA 7 8.855 -14.851 -5.326 56 HB2 ALA 7 HB2 ALA 7 9.215 -13.309 -4.543 57 HB3 ALA 7 HB3 ALA 7 9.512 -13.516 -6.268 58 H ALA 8 HN ALA 8 6.906 -12.052 -3.596 59 HA ALA 8 HA ALA 8 5.697 -14.219 -2.209 60 HB1 ALA 8 HB1 ALA 8 5.636 -11.332 -1.399 61 HB2 ALA 8 HB2 ALA 8 6.967 -12.441 -1.062 62 HB3 ALA 8 HB3 ALA 8 5.364 -12.750 -0.384 63 H VAL 9 HN VAL 9 4.410 -11.546 -4.092 64 HA VAL 9 HA VAL 9 1.720 -11.894 -3.320 65 HB VAL 9 HB VAL 9 2.366 -9.892 -4.483 66 HG11 VAL 9 HG11 VAL 9 3.125 -11.674 -6.779 67 HG12 VAL 9 HG12 VAL 9 4.227 -10.760 -5.749 68 HG13 VAL 9 HG13 VAL 9 3.108 -9.910 -6.813 69 HG21 VAL 9 HG21 VAL 9 0.676 -11.544 -6.348 70 HG22 VAL 9 HG22 VAL 9 0.740 -9.784 -6.281 71 HG23 VAL 9 HG23 VAL 9 0.082 -10.694 -4.922 72 H GLU 10 HN GLU 10 3.751 -13.505 -5.664 73 HA GLU 10 HA GLU 10 1.604 -15.132 -6.645 74 HB2 GLU 10 HB2 GLU 10 4.595 -15.481 -6.882 75 HB3 GLU 10 HB1 GLU 10 3.376 -16.350 -7.812 76 HG2 GLU 10 HG2 GLU 10 2.610 -14.227 -8.768 77 HG3 GLU 10 HG1 GLU 10 3.878 -13.379 -7.883 78 H GLN 11 HN GLN 11 3.778 -15.124 -4.010 79 HA GLN 11 HA GLN 11 3.401 -17.819 -3.190 80 HB2 GLN 11 HB2 GLN 11 4.383 -15.378 -1.794 81 HB3 GLN 11 HB1 GLN 11 4.206 -16.879 -0.966 82 HG2 GLN 11 HG2 GLN 11 5.924 -16.358 -3.292 83 HG3 GLN 11 HG1 GLN 11 6.450 -16.642 -1.657 84 HE21 GLN 11 HE21 GLN 11 6.299 -18.741 -0.795 85 HE22 GLN 11 HE22 GLN 11 6.133 -20.121 -1.820 86 H LEU 12 HN LEU 12 1.823 -14.742 -2.561 87 HA LEU 12 HA LEU 12 -0.020 -15.606 -0.644 88 HB2 LEU 12 HB2 LEU 12 -0.511 -13.487 -2.696 89 HB3 LEU 12 HB1 LEU 12 -1.306 -13.688 -1.227 90 HG LEU 12 HG LEU 12 1.602 -13.090 -1.241 91 HD11 LEU 12 HD11 LEU 12 0.225 -11.434 -2.591 92 HD12 LEU 12 HD12 LEU 12 1.092 -10.754 -1.222 93 HD13 LEU 12 HD13 LEU 12 -0.637 -11.072 -1.115 94 HD21 LEU 12 HD21 LEU 12 -0.650 -12.683 0.753 95 HD22 LEU 12 HD22 LEU 12 1.045 -12.258 1.024 96 HD23 LEU 12 HD23 LEU 12 0.567 -13.950 0.823 97 H THR 13 HN THR 13 -2.048 -16.413 -0.816 98 HA THR 13 HA THR 13 -2.715 -17.888 -3.186 99 HB THR 13 HB THR 13 -4.680 -18.613 -1.914 100 HG1 THR 13 HG1 THR 13 -4.655 -17.803 0.396 101 HG21 THR 13 HG21 THR 13 -3.562 -19.720 -0.044 102 HG22 THR 13 HG22 THR 13 -2.196 -18.621 -0.208 103 HG23 THR 13 HG23 THR 13 -2.558 -19.776 -1.492 104 H GLU 14 HN GLU 14 -5.234 -17.740 -3.763 105 HA GLU 14 HA GLU 14 -5.828 -15.287 -4.929 106 HB2 GLU 14 HB2 GLU 14 -7.146 -16.939 -5.805 107 HB3 GLU 14 HB1 GLU 14 -7.408 -17.714 -4.249 108 HG2 GLU 14 HG2 GLU 14 -9.033 -16.145 -3.646 109 HG3 GLU 14 HG1 GLU 14 -8.602 -15.092 -4.971 110 H GLU 15 HN GLU 15 -7.216 -16.656 -1.986 111 HA GLU 15 HA GLU 15 -8.734 -14.555 -1.078 112 HB2 GLU 15 HB2 GLU 15 -6.999 -16.235 0.733 113 HB3 GLU 15 HB1 GLU 15 -8.522 -15.462 1.133 114 HG2 GLU 15 HG2 GLU 15 -9.729 -16.997 -0.263 115 HG3 GLU 15 HG1 GLU 15 -8.217 -17.704 -0.843 116 H GLN 16 HN GLN 16 -5.308 -15.155 -0.534 117 HA GLN 16 HA GLN 16 -4.650 -13.112 1.140 118 HB2 GLN 16 HB2 GLN 16 -3.093 -14.400 -1.042 119 HB3 GLN 16 HB1 GLN 16 -2.405 -13.280 0.094 120 HG2 GLN 16 HG2 GLN 16 -3.706 -15.860 0.724 121 HG3 GLN 16 HG1 GLN 16 -1.998 -15.537 0.792 122 HE21 GLN 16 HE21 GLN 16 -1.234 -14.131 2.446 123 HE22 GLN 16 HE22 GLN 16 -2.159 -13.873 3.880 124 H LYS 17 HN LYS 17 -4.529 -13.016 -2.378 125 HA LYS 17 HA LYS 17 -3.812 -10.244 -2.324 126 HB2 LYS 17 HB2 LYS 17 -4.433 -12.137 -4.576 127 HB3 LYS 17 HB1 LYS 17 -3.819 -10.499 -4.777 128 HG2 LYS 17 HG2 LYS 17 -1.818 -11.037 -3.577 129 HG3 LYS 17 HG1 LYS 17 -2.437 -12.631 -3.176 130 HD2 LYS 17 HD2 LYS 17 -1.740 -11.600 -5.910 131 HD3 LYS 17 HD1 LYS 17 -0.840 -12.793 -4.961 132 HE2 LYS 17 HE2 LYS 17 -3.089 -14.092 -4.932 133 HE3 LYS 17 HE1 LYS 17 -3.491 -13.047 -6.291 134 HZ1 LYS 17 HZ1 LYS 17 -2.400 -15.314 -6.744 135 HZ2 LYS 17 HZ2 LYS 17 -0.969 -14.540 -6.294 136 HZ3 LYS 17 HZ3 LYS 17 -1.860 -13.963 -7.609 137 H ASN 18 HN ASN 18 -6.736 -12.060 -2.595 138 HA ASN 18 HA ASN 18 -8.312 -10.218 -3.987 139 HB2 ASN 18 HB2 ASN 18 -8.994 -12.530 -3.592 140 HB3 ASN 18 HB1 ASN 18 -9.177 -12.188 -1.881 141 HD21 ASN 18 HD21 ASN 18 -10.938 -10.993 -1.168 142 HD22 ASN 18 HD22 ASN 18 -12.304 -10.670 -2.185 143 H GLU 19 HN GLU 19 -7.832 -10.625 -0.503 144 HA GLU 19 HA GLU 19 -9.537 -8.508 0.251 145 HB2 GLU 19 HB2 GLU 19 -7.689 -10.295 1.556 146 HB3 GLU 19 HB1 GLU 19 -7.754 -8.693 2.273 147 HG2 GLU 19 HG2 GLU 19 -9.346 -10.036 3.353 148 HG3 GLU 19 HG1 GLU 19 -10.199 -8.884 2.367 149 H PHE 20 HN PHE 20 -6.147 -8.675 -0.572 150 HA PHE 20 HA PHE 20 -5.490 -6.034 0.196 151 HB2 PHE 20 HB2 PHE 20 -4.226 -7.717 -1.978 152 HB3 PHE 20 HB1 PHE 20 -3.506 -6.316 -1.194 153 HD1 PHE 20 HD1 PHE 20 -2.009 -8.758 -1.329 154 HD2 PHE 20 HD2 PHE 20 -4.910 -7.589 1.538 155 HE1 PHE 20 HE1 PHE 20 -0.960 -10.224 0.317 156 HE2 PHE 20 HE2 PHE 20 -3.856 -9.076 3.199 157 HZ PHE 20 HZ PHE 20 -1.873 -10.402 2.579 158 H LYS 21 HN LYS 21 -6.458 -7.522 -2.856 159 HA LYS 21 HA LYS 21 -6.619 -5.349 -4.545 160 HB2 LYS 21 HB2 LYS 21 -7.215 -7.777 -5.038 161 HB3 LYS 21 HB1 LYS 21 -8.750 -7.405 -4.349 162 HG2 LYS 21 HG2 LYS 21 -8.363 -7.259 -6.952 163 HG3 LYS 21 HG1 LYS 21 -9.455 -6.167 -6.101 164 HD2 LYS 21 HD2 LYS 21 -7.858 -4.427 -6.086 165 HD3 LYS 21 HD1 LYS 21 -6.564 -5.517 -6.578 166 HE2 LYS 21 HE2 LYS 21 -7.526 -3.951 -8.336 167 HE3 LYS 21 HE1 LYS 21 -7.337 -5.641 -8.775 168 HZ1 LYS 21 HZ1 LYS 21 -9.720 -5.926 -8.232 169 HZ2 LYS 21 HZ2 LYS 21 -9.447 -4.867 -9.515 170 HZ3 LYS 21 HZ3 LYS 21 -9.843 -4.255 -7.991 171 H ALA 22 HN ALA 22 -8.949 -6.554 -2.259 172 HA ALA 22 HA ALA 22 -11.001 -4.849 -2.811 173 HB1 ALA 22 HB1 ALA 22 -10.240 -5.974 -0.123 174 HB2 ALA 22 HB2 ALA 22 -11.238 -6.775 -1.337 175 HB3 ALA 22 HB3 ALA 22 -11.817 -5.309 -0.545 176 H ALA 23 HN ALA 23 -8.389 -4.461 -0.442 177 HA ALA 23 HA ALA 23 -9.244 -1.957 0.542 178 HB1 ALA 23 HB1 ALA 23 -7.784 -3.346 1.838 179 HB2 ALA 23 HB2 ALA 23 -6.967 -1.820 1.502 180 HB3 ALA 23 HB3 ALA 23 -6.535 -3.270 0.598 181 H PHE 24 HN PHE 24 -6.972 -2.826 -2.035 182 HA PHE 24 HA PHE 24 -6.069 -0.352 -2.839 183 HB2 PHE 24 HB2 PHE 24 -5.452 -2.369 -4.015 184 HB3 PHE 24 HB1 PHE 24 -7.092 -2.641 -4.475 185 HD1 PHE 24 HD1 PHE 24 -5.210 0.559 -4.728 186 HD2 PHE 24 HD2 PHE 24 -7.002 -2.698 -6.779 187 HE1 PHE 24 HE1 PHE 24 -4.874 1.723 -6.860 188 HE2 PHE 24 HE2 PHE 24 -6.676 -1.541 -8.916 189 HZ PHE 24 HZ PHE 24 -5.615 0.678 -8.960 190 H ASP 25 HN ASP 25 -8.904 -2.019 -3.860 191 HA ASP 25 HA ASP 25 -10.219 -0.072 -5.344 192 HB2 ASP 25 HB2 ASP 25 -10.774 -2.626 -4.800 193 HB3 ASP 25 HB1 ASP 25 -11.870 -1.868 -3.654 194 H ILE 26 HN ILE 26 -10.251 -0.554 -1.860 195 HA ILE 26 HA ILE 26 -12.385 1.340 -1.380 196 HB ILE 26 HB ILE 26 -10.426 0.293 0.641 197 HG12 ILE 26 HG12 ILE 26 -13.059 -0.995 0.190 198 HG13 ILE 26 HG11 ILE 26 -11.749 -1.385 -0.889 199 HG21 ILE 26 HG21 ILE 26 -11.846 2.110 1.383 200 HG22 ILE 26 HG22 ILE 26 -12.314 0.602 2.175 201 HG23 ILE 26 HG23 ILE 26 -13.273 1.229 0.838 202 HD11 ILE 26 HD11 ILE 26 -11.184 -2.950 0.546 203 HD12 ILE 26 HD12 ILE 26 -12.282 -2.311 1.776 204 HD13 ILE 26 HD13 ILE 26 -10.650 -1.658 1.627 205 H PHE 27 HN PHE 27 -8.919 1.265 -1.260 206 HA PHE 27 HA PHE 27 -8.272 3.732 -0.198 207 HB2 PHE 27 HB2 PHE 27 -7.117 1.730 -1.963 208 HB3 PHE 27 HB1 PHE 27 -6.642 3.344 -2.422 209 HD1 PHE 27 HD1 PHE 27 -4.943 4.397 -1.404 210 HD2 PHE 27 HD2 PHE 27 -6.717 1.025 0.467 211 HE1 PHE 27 HE1 PHE 27 -3.166 4.396 0.248 212 HE2 PHE 27 HE2 PHE 27 -4.931 1.041 2.173 213 HZ PHE 27 HZ PHE 27 -3.175 2.755 2.069 214 H VAL 28 HN VAL 28 -9.621 2.805 -3.247 215 HA VAL 28 HA VAL 28 -9.229 5.506 -4.316 216 HB VAL 28 HB VAL 28 -9.601 4.470 -6.553 217 HG11 VAL 28 HG11 VAL 28 -7.397 3.576 -6.759 218 HG12 VAL 28 HG12 VAL 28 -7.330 3.209 -5.036 219 HG13 VAL 28 HG13 VAL 28 -7.340 4.887 -5.579 220 HG21 VAL 28 HG21 VAL 28 -10.840 2.488 -5.780 221 HG22 VAL 28 HG22 VAL 28 -9.354 1.870 -5.049 222 HG23 VAL 28 HG23 VAL 28 -9.462 2.068 -6.798 223 H LEU 29 HN LEU 29 -11.459 4.763 -2.525 224 HA LEU 29 HA LEU 29 -13.799 4.338 -4.043 225 HB2 LEU 29 HB2 LEU 29 -13.499 5.767 -1.405 226 HB3 LEU 29 HB1 LEU 29 -15.018 5.240 -2.097 227 HG LEU 29 HG LEU 29 -12.774 3.439 -1.204 228 HD11 LEU 29 HD11 LEU 29 -14.289 2.736 0.544 229 HD12 LEU 29 HD12 LEU 29 -15.516 3.862 -0.035 230 HD13 LEU 29 HD13 LEU 29 -14.011 4.477 0.645 231 HD21 LEU 29 HD21 LEU 29 -15.457 2.830 -2.412 232 HD22 LEU 29 HD22 LEU 29 -14.437 1.642 -1.609 233 HD23 LEU 29 HD23 LEU 29 -13.870 2.437 -3.075 234 H GLY 30 HN GLY 30 -14.600 5.599 -5.560 235 HA2 GLY 30 HA2 GLY 30 -15.344 7.506 -6.621 236 HA3 GLY 30 HA1 GLY 30 -14.932 8.417 -5.179 237 H ALA 31 HN ALA 31 -12.422 6.477 -6.534 238 HA ALA 31 HA ALA 31 -10.851 8.792 -7.142 239 HB1 ALA 31 HB1 ALA 31 -9.825 6.742 -6.303 240 HB2 ALA 31 HB2 ALA 31 -9.139 7.216 -7.857 241 HB3 ALA 31 HB3 ALA 31 -10.307 5.900 -7.771 242 H GLU 32 HN GLU 32 -10.005 9.392 -9.169 243 HA GLU 32 HA GLU 32 -11.946 9.337 -11.250 244 HB2 GLU 32 HB2 GLU 32 -10.496 11.279 -10.790 245 HB3 GLU 32 HB1 GLU 32 -9.099 10.343 -11.305 246 HG2 GLU 32 HG2 GLU 32 -10.093 10.133 -13.542 247 HG3 GLU 32 HG1 GLU 32 -11.446 11.134 -13.012 248 H ASP 33 HN ASP 33 -8.723 7.904 -10.863 249 HA ASP 33 HA ASP 33 -9.133 6.408 -13.338 250 HB2 ASP 33 HB2 ASP 33 -7.065 7.720 -13.164 251 HB3 ASP 33 HB1 ASP 33 -6.629 6.806 -11.733 252 H GLY 34 HN GLY 34 -9.384 6.077 -10.031 253 HA2 GLY 34 HA2 GLY 34 -9.906 4.217 -8.752 254 HA3 GLY 34 HA1 GLY 34 -9.779 3.230 -10.197 255 H SER 35 HN SER 35 -7.143 5.201 -9.836 256 HA SER 35 HA SER 35 -5.526 3.045 -8.684 257 HB2 SER 35 HB2 SER 35 -3.608 4.295 -9.726 258 HB3 SER 35 HB1 SER 35 -4.753 3.710 -10.898 259 HG SER 35 HG SER 35 -5.095 5.654 -11.506 260 H ILE 36 HN ILE 36 -3.989 3.607 -7.057 261 HA ILE 36 HA ILE 36 -5.052 5.612 -5.279 262 HB ILE 36 HB ILE 36 -2.676 3.759 -5.091 263 HG12 ILE 36 HG12 ILE 36 -5.021 3.887 -3.261 264 HG13 ILE 36 HG11 ILE 36 -5.123 2.994 -4.781 265 HG21 ILE 36 HG21 ILE 36 -3.585 5.827 -3.094 266 HG22 ILE 36 HG22 ILE 36 -2.027 5.749 -3.918 267 HG23 ILE 36 HG23 ILE 36 -2.461 4.516 -2.734 268 HD11 ILE 36 HD11 ILE 36 -4.552 1.583 -2.839 269 HD12 ILE 36 HD12 ILE 36 -3.069 2.515 -2.634 270 HD13 ILE 36 HD13 ILE 36 -3.317 1.561 -4.096 271 H SER 37 HN SER 37 -4.709 7.603 -5.972 272 HA SER 37 HA SER 37 -1.972 8.388 -6.582 273 HB2 SER 37 HB2 SER 37 -2.841 10.239 -7.632 274 HB3 SER 37 HB1 SER 37 -4.237 9.182 -7.771 275 HG SER 37 HG SER 37 -5.290 10.285 -6.250 276 H THR 38 HN THR 38 -1.683 10.775 -5.405 277 HA THR 38 HA THR 38 -1.132 9.879 -2.801 278 HB THR 38 HB THR 38 -0.420 12.252 -2.400 279 HG1 THR 38 HG1 THR 38 -0.865 12.849 -5.104 280 HG21 THR 38 HG21 THR 38 1.146 10.697 -3.369 281 HG22 THR 38 HG22 THR 38 1.317 12.245 -4.198 282 HG23 THR 38 HG23 THR 38 0.448 10.917 -4.971 283 H LYS 39 HN LYS 39 -3.918 11.577 -4.095 284 HA LYS 39 HA LYS 39 -4.830 12.406 -1.480 285 HB2 LYS 39 HB2 LYS 39 -5.359 13.323 -3.927 286 HB3 LYS 39 HB1 LYS 39 -6.767 12.310 -3.646 287 HG2 LYS 39 HG2 LYS 39 -7.099 14.606 -2.881 288 HG3 LYS 39 HG1 LYS 39 -7.244 13.446 -1.580 289 HD2 LYS 39 HD2 LYS 39 -4.529 14.243 -1.733 290 HD3 LYS 39 HD1 LYS 39 -5.509 15.703 -1.792 291 HE2 LYS 39 HE2 LYS 39 -5.678 13.538 0.315 292 HE3 LYS 39 HE1 LYS 39 -4.920 15.115 0.515 293 HZ1 LYS 39 HZ1 LYS 39 -7.102 16.138 0.077 294 HZ2 LYS 39 HZ2 LYS 39 -7.107 15.159 1.453 295 HZ3 LYS 39 HZ3 LYS 39 -7.807 14.600 0.019 296 H GLU 40 HN GLU 40 -5.794 9.966 -3.855 297 HA GLU 40 HA GLU 40 -7.709 8.564 -2.427 298 HB2 GLU 40 HB2 GLU 40 -5.518 7.654 -4.278 299 HB3 GLU 40 HB1 GLU 40 -6.596 6.491 -3.526 300 HG2 GLU 40 HG2 GLU 40 -7.176 7.219 -5.856 301 HG3 GLU 40 HG1 GLU 40 -8.459 7.325 -4.667 302 H LEU 41 HN LEU 41 -4.193 8.014 -2.376 303 HA LEU 41 HA LEU 41 -4.054 6.292 -0.191 304 HB2 LEU 41 HB2 LEU 41 -2.152 6.808 -1.705 305 HB3 LEU 41 HB1 LEU 41 -2.109 8.422 -1.114 306 HG LEU 41 HG LEU 41 -0.824 7.891 0.647 307 HD11 LEU 41 HD11 LEU 41 -1.768 6.719 2.258 308 HD12 LEU 41 HD12 LEU 41 -1.189 5.256 1.457 309 HD13 LEU 41 HD13 LEU 41 -2.810 5.871 1.123 310 HD21 LEU 41 HD21 LEU 41 0.847 6.613 -0.149 311 HD22 LEU 41 HD22 LEU 41 -0.189 6.407 -1.550 312 HD23 LEU 41 HD23 LEU 41 -0.190 5.194 -0.275 313 H GLY 42 HN GLY 42 -3.903 9.840 -0.308 314 HA2 GLY 42 HA2 GLY 42 -3.423 10.433 2.335 315 HA3 GLY 42 HA1 GLY 42 -4.309 11.469 1.243 316 H LYS 43 HN LYS 43 -6.530 9.857 0.771 317 HA LYS 43 HA LYS 43 -8.334 10.364 2.788 318 HB2 LYS 43 HB2 LYS 43 -9.165 9.703 0.697 319 HB3 LYS 43 HB1 LYS 43 -8.162 8.268 0.645 320 HG2 LYS 43 HG2 LYS 43 -9.670 7.648 2.764 321 HG3 LYS 43 HG1 LYS 43 -10.796 8.698 1.896 322 HD2 LYS 43 HD2 LYS 43 -10.538 7.350 -0.117 323 HD3 LYS 43 HD1 LYS 43 -9.361 6.323 0.691 324 HE2 LYS 43 HE2 LYS 43 -11.566 5.266 0.589 325 HE3 LYS 43 HE1 LYS 43 -11.065 5.559 2.253 326 HZ1 LYS 43 HZ1 LYS 43 -13.394 6.135 1.861 327 HZ2 LYS 43 HZ2 LYS 43 -12.932 7.283 0.708 328 HZ3 LYS 43 HZ3 LYS 43 -12.490 7.483 2.326 329 H VAL 44 HN VAL 44 -6.602 7.370 2.175 330 HA VAL 44 HA VAL 44 -7.667 5.911 4.320 331 HB VAL 44 HB VAL 44 -5.172 5.510 2.709 332 HG11 VAL 44 HG11 VAL 44 -5.088 4.252 4.834 333 HG12 VAL 44 HG12 VAL 44 -5.271 3.182 3.442 334 HG13 VAL 44 HG13 VAL 44 -6.659 3.541 4.467 335 HG21 VAL 44 HG21 VAL 44 -7.096 5.614 1.334 336 HG22 VAL 44 HG22 VAL 44 -8.040 4.655 2.473 337 HG23 VAL 44 HG23 VAL 44 -6.740 3.901 1.543 338 H MET 45 HN MET 45 -4.925 7.977 4.016 339 HA MET 45 HA MET 45 -3.665 7.282 6.466 340 HB2 MET 45 HB2 MET 45 -3.495 9.817 4.823 341 HB3 MET 45 HB1 MET 45 -2.340 9.301 6.055 342 HG2 MET 45 HG2 MET 45 -2.997 7.589 3.699 343 HG3 MET 45 HG1 MET 45 -1.749 8.829 3.639 344 HE1 MET 45 HE1 MET 45 0.456 8.668 4.439 345 HE2 MET 45 HE2 MET 45 1.024 7.637 5.757 346 HE3 MET 45 HE3 MET 45 -0.150 8.919 6.079 347 H ARG 46 HN ARG 46 -6.021 9.752 5.527 348 HA ARG 46 HA ARG 46 -6.198 10.969 8.063 349 HB2 ARG 46 HB2 ARG 46 -7.716 10.968 5.558 350 HB3 ARG 46 HB1 ARG 46 -8.607 11.413 6.995 351 HG2 ARG 46 HG2 ARG 46 -7.819 13.472 6.500 352 HG3 ARG 46 HG1 ARG 46 -6.398 12.885 7.351 353 HD2 ARG 46 HD2 ARG 46 -5.513 12.091 5.161 354 HD3 ARG 46 HD1 ARG 46 -6.874 12.886 4.405 355 HE ARG 46 HE ARG 46 -5.600 14.735 6.065 356 HH11 ARG 46 HH11 ARG 46 -4.991 13.008 3.085 357 HH12 ARG 46 HH12 ARG 46 -3.991 14.263 2.426 358 HH21 ARG 46 HH21 ARG 46 -4.346 16.388 5.198 359 HH22 ARG 46 HH22 ARG 46 -3.626 16.196 3.633 360 H MET 47 HN MET 47 -7.636 8.212 6.539 361 HA MET 47 HA MET 47 -9.542 7.509 8.449 362 HB2 MET 47 HB2 MET 47 -8.014 6.216 6.255 363 HB3 MET 47 HB1 MET 47 -9.000 5.230 7.274 364 HG2 MET 47 HG2 MET 47 -10.969 6.452 6.654 365 HG3 MET 47 HG1 MET 47 -9.991 7.609 5.753 366 HE1 MET 47 HE1 MET 47 -9.264 3.779 5.824 367 HE2 MET 47 HE2 MET 47 -10.288 3.178 4.521 368 HE3 MET 47 HE3 MET 47 -11.017 3.814 5.995 369 H LEU 48 HN LEU 48 -6.113 7.404 8.433 370 HA LEU 48 HA LEU 48 -6.047 5.556 10.697 371 HB2 LEU 48 HB2 LEU 48 -3.747 6.660 9.155 372 HB3 LEU 48 HB1 LEU 48 -3.685 5.372 10.330 373 HG LEU 48 HG LEU 48 -4.972 5.289 7.610 374 HD11 LEU 48 HD11 LEU 48 -2.648 3.767 8.788 375 HD12 LEU 48 HD12 LEU 48 -2.532 5.081 7.616 376 HD13 LEU 48 HD13 LEU 48 -3.310 3.564 7.167 377 HD21 LEU 48 HD21 LEU 48 -6.302 4.100 9.353 378 HD22 LEU 48 HD22 LEU 48 -4.890 3.087 9.670 379 HD23 LEU 48 HD23 LEU 48 -5.669 3.050 8.090 380 H GLY 49 HN GLY 49 -6.337 8.783 10.208 381 HA2 GLY 49 HA2 GLY 49 -6.427 10.293 12.040 382 HA3 GLY 49 HA1 GLY 49 -5.212 9.328 12.861 383 H GLN 50 HN GLN 50 -4.105 9.530 9.799 384 HA GLN 50 HA GLN 50 -2.132 11.511 10.433 385 HB2 GLN 50 HB2 GLN 50 -2.690 9.999 7.875 386 HB3 GLN 50 HB1 GLN 50 -1.309 11.021 8.184 387 HG2 GLN 50 HG2 GLN 50 -1.836 8.725 10.019 388 HG3 GLN 50 HG1 GLN 50 -1.020 8.460 8.473 389 HE21 GLN 50 HE21 GLN 50 -0.840 10.144 11.563 390 HE22 GLN 50 HE22 GLN 50 0.865 10.426 11.517 391 H ASN 51 HN ASN 51 -1.653 13.199 8.734 392 HA ASN 51 HA ASN 51 -3.838 13.808 6.952 393 HB2 ASN 51 HB2 ASN 51 -3.671 16.285 7.548 394 HB3 ASN 51 HB1 ASN 51 -4.520 15.256 8.687 395 HD21 ASN 51 HD21 ASN 51 -1.554 17.038 8.116 396 HD22 ASN 51 HD22 ASN 51 -1.064 17.104 9.773 397 HA PRO 52 HA PRO 52 0.540 13.770 5.319 398 HB2 PRO 52 HB2 PRO 52 -0.334 12.781 2.906 399 HB3 PRO 52 HB1 PRO 52 0.319 11.845 4.219 400 HG2 PRO 52 HG2 PRO 52 -2.499 12.312 3.440 401 HG3 PRO 52 HG1 PRO 52 -1.758 10.837 4.082 402 HD2 PRO 52 HD2 PRO 52 -3.278 12.400 5.621 403 HD3 PRO 52 HD1 PRO 52 -1.841 11.606 6.256 404 H THR 53 HN THR 53 1.478 15.177 3.973 405 HA THR 53 HA THR 53 -0.253 16.596 2.127 406 HB THR 53 HB THR 53 1.820 17.929 1.585 407 HG1 THR 53 HG1 THR 53 2.851 16.242 3.627 408 HG21 THR 53 HG21 THR 53 1.779 19.241 3.640 409 HG22 THR 53 HG22 THR 53 0.979 17.914 4.481 410 HG23 THR 53 HG23 THR 53 0.153 18.757 3.170 411 HA PRO 54 HA PRO 54 0.325 13.978 -1.232 412 HB2 PRO 54 HB2 PRO 54 0.994 16.453 -2.728 413 HB3 PRO 54 HB1 PRO 54 -0.105 15.139 -3.165 414 HG2 PRO 54 HG2 PRO 54 -1.128 17.298 -2.204 415 HG3 PRO 54 HG1 PRO 54 -1.632 15.766 -1.514 416 HD2 PRO 54 HD2 PRO 54 0.335 17.745 -0.434 417 HD3 PRO 54 HD1 PRO 54 -0.994 16.920 0.412 418 H GLU 55 HN GLU 55 2.930 16.223 -0.574 419 HA GLU 55 HA GLU 55 4.908 15.091 -2.212 420 HB2 GLU 55 HB2 GLU 55 5.277 16.331 0.474 421 HB3 GLU 55 HB1 GLU 55 6.497 16.145 -0.759 422 HG2 GLU 55 HG2 GLU 55 5.962 18.170 -1.361 423 HG3 GLU 55 HG1 GLU 55 4.538 17.426 -2.027 424 H GLU 56 HN GLU 56 3.892 14.388 1.075 425 HA GLU 56 HA GLU 56 5.761 12.373 1.679 426 HB2 GLU 56 HB2 GLU 56 3.035 13.117 2.737 427 HB3 GLU 56 HB1 GLU 56 4.007 11.867 3.449 428 HG2 GLU 56 HG2 GLU 56 5.718 13.410 4.047 429 HG3 GLU 56 HG1 GLU 56 4.941 14.674 3.110 430 H LEU 57 HN LEU 57 2.344 12.216 0.947 431 HA LEU 57 HA LEU 57 1.931 9.549 0.550 432 HB2 LEU 57 HB2 LEU 57 0.786 11.860 -0.968 433 HB3 LEU 57 HB1 LEU 57 0.108 10.244 -0.957 434 HG LEU 57 HG LEU 57 0.527 11.617 1.641 435 HD11 LEU 57 HD11 LEU 57 -0.551 13.387 0.521 436 HD12 LEU 57 HD12 LEU 57 -1.796 12.542 1.438 437 HD13 LEU 57 HD13 LEU 57 -1.666 12.287 -0.306 438 HD21 LEU 57 HD21 LEU 57 -1.542 10.338 2.158 439 HD22 LEU 57 HD22 LEU 57 -0.172 9.349 1.680 440 HD23 LEU 57 HD23 LEU 57 -1.470 9.670 0.533 441 H GLN 58 HN GLN 58 3.294 11.857 -1.745 442 HA GLN 58 HA GLN 58 3.045 10.247 -4.025 443 HB2 GLN 58 HB2 GLN 58 3.509 12.736 -3.972 444 HB3 GLN 58 HB1 GLN 58 5.184 12.330 -3.622 445 HG2 GLN 58 HG2 GLN 58 5.430 11.219 -5.724 446 HG3 GLN 58 HG1 GLN 58 3.704 11.356 -6.056 447 HE21 GLN 58 HE21 GLN 58 5.603 13.906 -4.630 448 HE22 GLN 58 HE22 GLN 58 5.527 14.984 -5.978 449 H GLU 59 HN GLU 59 5.746 10.621 -1.764 450 HA GLU 59 HA GLU 59 7.513 9.095 -3.360 451 HB2 GLU 59 HB2 GLU 59 8.983 9.080 -1.414 452 HB3 GLU 59 HB1 GLU 59 8.347 10.680 -1.756 453 HG2 GLU 59 HG2 GLU 59 6.748 10.468 0.046 454 HG3 GLU 59 HG1 GLU 59 7.294 8.824 0.368 455 H MET 60 HN MET 60 5.226 8.123 -0.836 456 HA MET 60 HA MET 60 6.390 5.495 -0.757 457 HB2 MET 60 HB2 MET 60 4.310 4.888 0.523 458 HB3 MET 60 HB1 MET 60 5.375 6.043 1.256 459 HG2 MET 60 HG2 MET 60 3.873 7.844 0.582 460 HG3 MET 60 HG1 MET 60 2.803 6.633 -0.091 461 HE1 MET 60 HE1 MET 60 0.718 7.373 3.066 462 HE2 MET 60 HE2 MET 60 0.795 7.403 1.320 463 HE3 MET 60 HE3 MET 60 1.632 8.634 2.251 464 H ILE 61 HN ILE 61 3.791 7.058 -2.460 465 HA ILE 61 HA ILE 61 2.833 4.716 -3.768 466 HB ILE 61 HB ILE 61 2.675 7.654 -4.437 467 HG12 ILE 61 HG12 ILE 61 0.624 5.612 -3.579 468 HG13 ILE 61 HG11 ILE 61 1.394 6.793 -2.528 469 HG21 ILE 61 HG21 ILE 61 1.234 7.214 -6.279 470 HG22 ILE 61 HG22 ILE 61 1.238 5.490 -5.941 471 HG23 ILE 61 HG23 ILE 61 2.703 6.270 -6.534 472 HD11 ILE 61 HD11 ILE 61 0.375 8.560 -4.035 473 HD12 ILE 61 HD12 ILE 61 -0.724 7.647 -3.004 474 HD13 ILE 61 HD13 ILE 61 -0.596 7.247 -4.723 475 H ASP 62 HN ASP 62 5.218 7.179 -4.507 476 HA ASP 62 HA ASP 62 5.987 6.368 -7.061 477 HB2 ASP 62 HB2 ASP 62 6.597 8.525 -6.036 478 HB3 ASP 62 HB1 ASP 62 7.657 7.682 -4.916 479 H GLU 63 HN GLU 63 7.058 5.314 -3.891 480 HA GLU 63 HA GLU 63 9.371 3.950 -4.541 481 HB2 GLU 63 HB2 GLU 63 8.248 4.462 -2.258 482 HB3 GLU 63 HB1 GLU 63 7.506 2.890 -2.487 483 HG2 GLU 63 HG2 GLU 63 9.581 1.791 -2.497 484 HG3 GLU 63 HG1 GLU 63 10.463 3.307 -2.646 485 H VAL 64 HN VAL 64 6.022 2.888 -4.761 486 HA VAL 64 HA VAL 64 6.962 0.334 -5.830 487 HB VAL 64 HB VAL 64 4.901 -0.627 -5.422 488 HG11 VAL 64 HG11 VAL 64 5.930 -0.239 -3.332 489 HG12 VAL 64 HG12 VAL 64 4.219 0.152 -3.134 490 HG13 VAL 64 HG13 VAL 64 5.403 1.445 -3.308 491 HG21 VAL 64 HG21 VAL 64 3.553 2.007 -4.955 492 HG22 VAL 64 HG22 VAL 64 2.828 0.423 -5.260 493 HG23 VAL 64 HG23 VAL 64 3.662 1.278 -6.558 494 H ASP 65 HN ASP 65 5.358 3.268 -6.789 495 HA ASP 65 HA ASP 65 4.049 2.553 -9.102 496 HB2 ASP 65 HB2 ASP 65 3.710 4.748 -8.389 497 HB3 ASP 65 HB1 ASP 65 5.429 5.078 -8.275 498 H GLU 66 HN GLU 66 4.988 1.079 -10.343 499 HA GLU 66 HA GLU 66 7.494 1.685 -11.700 500 HB2 GLU 66 HB2 GLU 66 6.686 -0.615 -10.809 501 HB3 GLU 66 HB1 GLU 66 5.718 -0.620 -12.257 502 HG2 GLU 66 HG2 GLU 66 7.624 -0.526 -13.652 503 HG3 GLU 66 HG1 GLU 66 8.662 -0.302 -12.252 504 H ASP 67 HN ASP 67 4.173 2.107 -11.974 505 HA ASP 67 HA ASP 67 3.885 1.854 -14.815 506 HB2 ASP 67 HB2 ASP 67 2.086 1.401 -13.160 507 HB3 ASP 67 HB1 ASP 67 2.049 3.112 -12.764 508 H GLY 68 HN GLY 68 5.080 4.280 -12.805 509 HA2 GLY 68 HA2 GLY 68 5.947 6.344 -13.303 510 HA3 GLY 68 HA1 GLY 68 5.659 5.980 -14.992 511 H SER 69 HN SER 69 3.007 5.930 -12.725 512 HA SER 69 HA SER 69 1.963 8.312 -14.067 513 HB2 SER 69 HB2 SER 69 -0.206 7.265 -12.984 514 HB3 SER 69 HB1 SER 69 0.423 6.653 -14.507 515 HG SER 69 HG SER 69 0.847 4.824 -13.567 516 H GLY 70 HN GLY 70 3.115 7.137 -11.100 517 HA2 GLY 70 HA2 GLY 70 3.230 8.168 -9.024 518 HA3 GLY 70 HA1 GLY 70 2.332 9.525 -9.683 519 H THR 71 HN THR 71 0.890 6.652 -10.480 520 HA THR 71 HA THR 71 -0.835 6.686 -8.110 521 HB THR 71 HB THR 71 -2.668 5.832 -9.558 522 HG1 THR 71 HG1 THR 71 -0.858 5.490 -11.338 523 HG21 THR 71 HG21 THR 71 -3.323 7.951 -10.467 524 HG22 THR 71 HG22 THR 71 -1.665 8.553 -10.360 525 HG23 THR 71 HG23 THR 71 -2.568 8.189 -8.889 526 H VAL 72 HN VAL 72 -1.336 4.762 -7.234 527 HA VAL 72 HA VAL 72 0.188 2.484 -8.221 528 HB VAL 72 HB VAL 72 -1.089 3.193 -5.593 529 HG11 VAL 72 HG11 VAL 72 -1.762 0.846 -6.244 530 HG12 VAL 72 HG12 VAL 72 -0.754 0.930 -4.797 531 HG13 VAL 72 HG13 VAL 72 -0.056 0.445 -6.326 532 HG21 VAL 72 HG21 VAL 72 1.654 2.117 -6.238 533 HG22 VAL 72 HG22 VAL 72 1.106 2.891 -4.756 534 HG23 VAL 72 HG23 VAL 72 1.255 3.823 -6.235 535 H ASP 73 HN ASP 73 -0.740 0.775 -9.135 536 HA ASP 73 HA ASP 73 -3.654 0.527 -8.918 537 HB2 ASP 73 HB2 ASP 73 -3.658 -0.623 -10.989 538 HB3 ASP 73 HB1 ASP 73 -2.670 0.802 -11.225 539 H PHE 74 HN PHE 74 -3.786 -2.236 -9.622 540 HA PHE 74 HA PHE 74 -3.820 -3.011 -6.947 541 HB2 PHE 74 HB2 PHE 74 -5.408 -3.927 -8.479 542 HB3 PHE 74 HB1 PHE 74 -4.137 -4.716 -9.402 543 HD1 PHE 74 HD1 PHE 74 -5.007 -6.905 -9.192 544 HD2 PHE 74 HD2 PHE 74 -4.163 -4.600 -5.719 545 HE1 PHE 74 HE1 PHE 74 -5.239 -8.913 -7.799 546 HE2 PHE 74 HE2 PHE 74 -4.388 -6.608 -4.328 547 HZ PHE 74 HZ PHE 74 -4.934 -8.767 -5.366 548 H ASP 75 HN ASP 75 -1.507 -4.160 -9.484 549 HA ASP 75 HA ASP 75 -0.435 -5.972 -7.577 550 HB2 ASP 75 HB2 ASP 75 1.278 -6.459 -9.248 551 HB3 ASP 75 HB1 ASP 75 -0.337 -6.577 -9.900 552 H GLU 76 HN GLU 76 0.309 -2.702 -8.567 553 HA GLU 76 HA GLU 76 2.784 -2.387 -7.308 554 HB2 GLU 76 HB2 GLU 76 0.614 -0.401 -7.520 555 HB3 GLU 76 HB1 GLU 76 2.297 -0.056 -7.360 556 HG2 GLU 76 HG2 GLU 76 1.337 -1.684 -9.614 557 HG3 GLU 76 HG1 GLU 76 1.079 0.038 -9.669 558 H PHE 77 HN PHE 77 -0.394 -1.530 -6.134 559 HA PHE 77 HA PHE 77 0.140 -1.071 -3.457 560 HB2 PHE 77 HB2 PHE 77 -2.017 -0.605 -4.503 561 HB3 PHE 77 HB1 PHE 77 -2.297 -2.321 -4.746 562 HD1 PHE 77 HD1 PHE 77 -3.123 -3.688 -3.006 563 HD2 PHE 77 HD2 PHE 77 -2.129 0.372 -2.231 564 HE1 PHE 77 HE1 PHE 77 -4.309 -3.812 -0.860 565 HE2 PHE 77 HE2 PHE 77 -3.314 0.255 -0.075 566 HZ PHE 77 HZ PHE 77 -4.420 -1.838 0.612 567 H LEU 78 HN LEU 78 -0.381 -4.054 -5.176 568 HA LEU 78 HA LEU 78 -0.724 -5.694 -2.906 569 HB2 LEU 78 HB2 LEU 78 -1.665 -6.194 -5.067 570 HB3 LEU 78 HB1 LEU 78 -0.060 -6.365 -5.726 571 HG LEU 78 HG LEU 78 0.247 -8.453 -4.821 572 HD11 LEU 78 HD11 LEU 78 -1.861 -7.784 -2.803 573 HD12 LEU 78 HD12 LEU 78 -0.124 -7.912 -2.496 574 HD13 LEU 78 HD13 LEU 78 -1.053 -9.346 -2.959 575 HD21 LEU 78 HD21 LEU 78 -1.730 -9.725 -5.162 576 HD22 LEU 78 HD22 LEU 78 -1.697 -8.425 -6.358 577 HD23 LEU 78 HD23 LEU 78 -2.732 -8.300 -4.927 578 H VAL 79 HN VAL 79 2.102 -5.247 -5.079 579 HA VAL 79 HA VAL 79 3.820 -6.946 -3.726 580 HB VAL 79 HB VAL 79 4.077 -5.223 -5.836 581 HG11 VAL 79 HG11 VAL 79 4.603 -3.290 -4.464 582 HG12 VAL 79 HG12 VAL 79 6.052 -3.815 -5.330 583 HG13 VAL 79 HG13 VAL 79 5.866 -4.208 -3.620 584 HG21 VAL 79 HG21 VAL 79 6.202 -6.268 -6.123 585 HG22 VAL 79 HG22 VAL 79 5.171 -7.420 -5.289 586 HG23 VAL 79 HG23 VAL 79 6.375 -6.507 -4.398 587 H MET 80 HN MET 80 2.884 -3.633 -3.033 588 HA MET 80 HA MET 80 4.825 -3.355 -0.961 589 HB2 MET 80 HB2 MET 80 4.040 -1.429 -2.284 590 HB3 MET 80 HB1 MET 80 2.442 -1.623 -1.595 591 HG2 MET 80 HG2 MET 80 3.648 0.160 -0.476 592 HG3 MET 80 HG1 MET 80 3.340 -1.181 0.635 593 HE1 MET 80 HE1 MET 80 6.781 -0.202 2.051 594 HE2 MET 80 HE2 MET 80 5.209 -0.899 2.444 595 HE3 MET 80 HE3 MET 80 5.307 0.706 1.736 596 H MET 81 HN MET 81 1.538 -4.357 -1.257 597 HA MET 81 HA MET 81 0.717 -4.306 1.405 598 HB2 MET 81 HB2 MET 81 -0.305 -5.231 -0.998 599 HB3 MET 81 HB1 MET 81 -0.112 -6.685 -0.047 600 HG2 MET 81 HG2 MET 81 -2.168 -4.765 0.049 601 HG3 MET 81 HG1 MET 81 -2.013 -6.268 0.952 602 HE1 MET 81 HE1 MET 81 -1.734 -2.311 1.194 603 HE2 MET 81 HE2 MET 81 -0.118 -2.903 0.834 604 HE3 MET 81 HE3 MET 81 -0.462 -2.190 2.414 605 H VAL 82 HN VAL 82 2.177 -7.064 -0.362 606 HA VAL 82 HA VAL 82 2.616 -8.477 2.058 607 HB VAL 82 HB VAL 82 2.394 -9.698 -0.028 608 HG11 VAL 82 HG11 VAL 82 4.922 -8.319 -0.686 609 HG12 VAL 82 HG12 VAL 82 3.425 -8.394 -1.608 610 HG13 VAL 82 HG13 VAL 82 4.451 -9.825 -1.475 611 HG21 VAL 82 HG21 VAL 82 4.184 -11.303 0.326 612 HG22 VAL 82 HG22 VAL 82 3.485 -10.766 1.852 613 HG23 VAL 82 HG23 VAL 82 5.043 -10.130 1.325 614 H ARG 83 HN ARG 83 4.393 -6.068 0.363 615 HA ARG 83 HA ARG 83 6.916 -6.434 1.617 616 HB2 ARG 83 HB2 ARG 83 6.371 -5.053 -0.450 617 HB3 ARG 83 HB1 ARG 83 5.762 -3.842 0.662 618 HG2 ARG 83 HG2 ARG 83 7.923 -3.509 1.612 619 HG3 ARG 83 HG1 ARG 83 8.571 -4.883 0.713 620 HD2 ARG 83 HD2 ARG 83 8.212 -3.749 -1.381 621 HD3 ARG 83 HD1 ARG 83 7.419 -2.408 -0.561 622 HE ARG 83 HE ARG 83 10.282 -3.074 -0.288 623 HH11 ARG 83 HH11 ARG 83 7.640 -0.782 -0.319 624 HH12 ARG 83 HH12 ARG 83 8.673 0.610 -0.143 625 HH21 ARG 83 HH21 ARG 83 11.638 -1.242 -0.043 626 HH22 ARG 83 HH22 ARG 83 10.930 0.341 0.005 627 H SER 84 HN SER 84 4.165 -4.314 2.332 628 HA SER 84 HA SER 84 5.328 -3.013 4.545 629 HB2 SER 84 HB2 SER 84 2.430 -3.395 3.764 630 HB3 SER 84 HB1 SER 84 2.979 -2.303 5.036 631 HG SER 84 HG SER 84 3.457 -2.172 2.254 632 H MET 85 HN MET 85 3.162 -5.812 4.294 633 HA MET 85 HA MET 85 2.715 -6.127 7.036 634 HB2 MET 85 HB2 MET 85 1.942 -8.336 6.548 635 HB3 MET 85 HB1 MET 85 1.410 -7.257 5.268 636 HG2 MET 85 HG2 MET 85 3.204 -8.009 3.870 637 HG3 MET 85 HG1 MET 85 3.798 -9.053 5.144 638 HE1 MET 85 HE1 MET 85 -0.381 -9.141 3.866 639 HE2 MET 85 HE2 MET 85 0.469 -9.242 2.320 640 HE3 MET 85 HE3 MET 85 0.813 -7.909 3.442 641 H LYS 86 HN LYS 86 5.435 -6.896 5.057 642 HA LYS 86 HA LYS 86 6.632 -8.717 6.902 643 HB2 LYS 86 HB2 LYS 86 7.205 -7.667 4.247 644 HB3 LYS 86 HB1 LYS 86 8.642 -7.916 5.224 645 HG2 LYS 86 HG2 LYS 86 8.219 -9.883 3.933 646 HG3 LYS 86 HG1 LYS 86 7.904 -10.234 5.626 647 HD2 LYS 86 HD2 LYS 86 5.504 -9.918 5.223 648 HD3 LYS 86 HD1 LYS 86 5.840 -9.630 3.517 649 HE2 LYS 86 HE2 LYS 86 5.134 -11.910 3.783 650 HE3 LYS 86 HE1 LYS 86 6.856 -11.898 3.402 651 HZ1 LYS 86 HZ1 LYS 86 6.278 -13.441 5.202 652 HZ2 LYS 86 HZ2 LYS 86 5.743 -12.144 6.140 653 HZ3 LYS 86 HZ3 LYS 86 7.369 -12.254 5.701 654 H ASP 87 HN ASP 87 7.062 -5.302 6.038 655 HA ASP 87 HA ASP 87 9.281 -5.025 7.844 656 HB2 ASP 87 HB2 ASP 87 9.295 -3.585 5.919 657 HB3 ASP 87 HB1 ASP 87 7.708 -2.937 6.330 658 H ASP 88 HN ASP 88 8.403 -5.750 9.770 659 HA ASP 88 HA ASP 88 6.395 -4.199 11.130 660 HB2 ASP 88 HB2 ASP 88 6.819 -6.610 11.617 661 HB3 ASP 88 HB1 ASP 88 8.398 -6.163 12.257 662 H SER 89 HN SER 89 9.665 -3.908 10.427 663 HA SER 89 HA SER 89 11.431 -2.736 11.174 664 HB2 SER 89 HB2 SER 89 9.396 -1.078 12.686 665 HB3 SER 89 HB1 SER 89 11.049 -0.604 12.294 666 HG SER 89 HG SER 89 9.926 -1.310 10.016 667 H LYS 90 HN LYS 90 12.212 -1.675 13.557 668 HA LYS 90 HA LYS 90 12.965 -2.152 15.629 669 HB2 LYS 90 HB2 LYS 90 10.621 -2.227 16.295 670 HB3 LYS 90 HB1 LYS 90 10.526 -3.912 15.816 671 HG2 LYS 90 HG2 LYS 90 12.021 -4.555 17.574 672 HG3 LYS 90 HG1 LYS 90 12.338 -2.868 17.969 673 HD2 LYS 90 HD2 LYS 90 10.786 -3.829 19.572 674 HD3 LYS 90 HD1 LYS 90 9.986 -2.584 18.614 675 HE2 LYS 90 HE2 LYS 90 9.024 -4.341 17.184 676 HE3 LYS 90 HE1 LYS 90 9.783 -5.564 18.201 677 HZ1 LYS 90 HZ1 LYS 90 8.469 -4.821 20.060 678 HZ2 LYS 90 HZ2 LYS 90 7.444 -5.181 18.765 679 HZ3 LYS 90 HZ3 LYS 90 7.791 -3.571 19.142 680 H GLY 136 HN GLY 136 11.566 -5.352 14.932 681 HA2 GLY 136 HA2 GLY 136 14.134 -6.600 15.430 682 HA3 GLY 136 HA1 GLY 136 12.623 -7.420 15.048 683 H LYS 137 HN LYS 137 12.352 -5.464 12.742 684 HA LYS 137 HA LYS 137 13.877 -7.001 10.816 685 HB2 LYS 137 HB2 LYS 137 11.784 -4.855 10.484 686 HB3 LYS 137 HB1 LYS 137 12.673 -5.534 9.132 687 HG2 LYS 137 HG2 LYS 137 10.798 -6.993 10.983 688 HG3 LYS 137 HG1 LYS 137 10.548 -6.619 9.277 689 HD2 LYS 137 HD2 LYS 137 12.452 -8.048 8.693 690 HD3 LYS 137 HD1 LYS 137 12.680 -8.432 10.398 691 HE2 LYS 137 HE2 LYS 137 11.491 -10.246 9.474 692 HE3 LYS 137 HE1 LYS 137 10.322 -9.305 10.398 693 HZ1 LYS 137 HZ1 LYS 137 9.468 -8.357 8.399 694 HZ2 LYS 137 HZ2 LYS 137 9.515 -10.038 8.194 695 HZ3 LYS 137 HZ3 LYS 137 10.690 -9.063 7.464 696 H PHE 138 HN PHE 138 13.400 -4.077 9.489 697 HA PHE 138 HA PHE 138 16.133 -3.561 9.086 698 HB2 PHE 138 HB2 PHE 138 13.730 -1.778 8.641 699 HB3 PHE 138 HB1 PHE 138 15.299 -1.583 7.887 700 HD1 PHE 138 HD1 PHE 138 12.120 -2.506 7.227 701 HD2 PHE 138 HD2 PHE 138 16.072 -4.020 6.811 702 HE1 PHE 138 HE1 PHE 138 11.370 -3.936 5.371 703 HE2 PHE 138 HE2 PHE 138 15.330 -5.453 4.956 704 HZ PHE 138 HZ PHE 138 12.978 -5.408 4.235 705 H LYS 139 HN LYS 139 16.448 -3.523 11.627 706 HA LYS 139 HA LYS 139 17.064 -2.336 13.492 707 HB2 LYS 139 HB2 LYS 139 17.591 -0.116 11.513 708 HB3 LYS 139 HB1 LYS 139 18.433 -0.426 13.026 709 HG2 LYS 139 HG2 LYS 139 19.604 -2.222 12.161 710 HG3 LYS 139 HG1 LYS 139 18.449 -2.471 10.851 711 HD2 LYS 139 HD2 LYS 139 19.194 -0.233 9.943 712 HD3 LYS 139 HD1 LYS 139 20.507 -0.294 11.121 713 HE2 LYS 139 HE2 LYS 139 21.334 -2.342 10.155 714 HE3 LYS 139 HE1 LYS 139 19.960 -2.419 9.055 715 HZ1 LYS 139 HZ1 LYS 139 20.732 -0.331 8.061 716 HZ2 LYS 139 HZ2 LYS 139 21.870 -1.571 7.911 717 HZ3 LYS 139 HZ3 LYS 139 22.093 -0.360 9.066 718 H ARG 140 HN ARG 140 16.931 0.707 13.528 719 HA ARG 140 HA ARG 140 14.298 1.212 14.408 720 HB2 ARG 140 HB2 ARG 140 14.934 3.655 13.818 721 HB3 ARG 140 HB1 ARG 140 15.802 2.836 15.098 722 HG2 ARG 140 HG2 ARG 140 17.424 4.001 13.846 723 HG3 ARG 140 HG1 ARG 140 17.591 2.312 13.375 724 HD2 ARG 140 HD2 ARG 140 17.720 3.638 11.393 725 HD3 ARG 140 HD1 ARG 140 16.165 2.812 11.382 726 HE ARG 140 HE ARG 140 15.601 5.216 12.515 727 HH11 ARG 140 HH11 ARG 140 17.145 4.233 9.537 728 HH12 ARG 140 HH12 ARG 140 16.660 5.653 8.667 729 HH21 ARG 140 HH21 ARG 140 14.966 7.097 11.377 730 HH22 ARG 140 HH22 ARG 140 15.433 7.283 9.714 731 HA PRO 141 HA PRO 141 11.754 1.159 10.994 732 HB2 PRO 141 HB2 PRO 141 10.796 3.877 11.805 733 HB3 PRO 141 HB1 PRO 141 9.878 2.393 11.532 734 HG2 PRO 141 HG2 PRO 141 10.332 3.184 14.008 735 HG3 PRO 141 HG1 PRO 141 10.491 1.471 13.590 736 HD2 PRO 141 HD2 PRO 141 12.604 3.556 13.962 737 HD3 PRO 141 HD1 PRO 141 12.567 1.880 14.539 738 H THR 142 HN THR 142 12.228 1.474 8.946 739 HA THR 142 HA THR 142 14.162 3.524 8.257 740 HB THR 142 HB THR 142 13.104 1.393 6.418 741 HG1 THR 142 HG1 THR 142 14.437 1.063 8.761 742 HG21 THR 142 HG21 THR 142 14.576 3.072 5.418 743 HG22 THR 142 HG22 THR 142 15.391 1.506 5.492 744 HG23 THR 142 HG23 THR 142 15.787 2.762 6.661 745 H LEU 143 HN LEU 143 10.944 2.497 7.426 746 HA LEU 143 HA LEU 143 10.716 4.666 5.481 747 HB2 LEU 143 HB2 LEU 143 9.196 2.107 5.867 748 HB3 LEU 143 HB1 LEU 143 8.614 3.406 4.852 749 HG LEU 143 HG LEU 143 9.691 1.735 3.483 750 HD11 LEU 143 HD11 LEU 143 11.442 4.167 3.711 751 HD12 LEU 143 HD12 LEU 143 9.888 4.112 2.862 752 HD13 LEU 143 HD13 LEU 143 11.240 3.130 2.298 753 HD21 LEU 143 HD21 LEU 143 11.992 1.144 3.669 754 HD22 LEU 143 HD22 LEU 143 11.226 0.864 5.234 755 HD23 LEU 143 HD23 LEU 143 12.226 2.297 4.979 756 H ARG 144 HN ARG 144 10.352 6.385 6.841 757 HA ARG 144 HA ARG 144 7.720 6.434 8.085 758 HB2 ARG 144 HB2 ARG 144 9.232 5.720 9.884 759 HB3 ARG 144 HB1 ARG 144 10.236 7.136 9.599 760 HG2 ARG 144 HG2 ARG 144 8.325 8.578 10.185 761 HG3 ARG 144 HG1 ARG 144 7.382 7.133 10.553 762 HD2 ARG 144 HD2 ARG 144 10.005 7.759 11.878 763 HD3 ARG 144 HD1 ARG 144 8.457 8.301 12.520 764 HE ARG 144 HE ARG 144 8.446 5.499 12.036 765 HH11 ARG 144 HH11 ARG 144 9.681 7.918 14.235 766 HH12 ARG 144 HH12 ARG 144 9.635 6.875 15.621 767 HH21 ARG 144 HH21 ARG 144 8.375 4.108 13.857 768 HH22 ARG 144 HH22 ARG 144 8.901 4.702 15.402 769 H ARG 145 HN ARG 145 7.543 7.783 6.117 770 HA ARG 145 HA ARG 145 8.110 10.594 6.833 771 HB2 ARG 145 HB2 ARG 145 8.559 9.761 4.459 772 HB3 ARG 145 HB1 ARG 145 6.811 9.592 4.306 773 HG2 ARG 145 HG2 ARG 145 7.079 11.700 3.478 774 HG3 ARG 145 HG1 ARG 145 6.834 12.042 5.198 775 HD2 ARG 145 HD2 ARG 145 8.709 13.314 4.276 776 HD3 ARG 145 HD1 ARG 145 9.209 12.202 5.550 777 HE ARG 145 HE ARG 145 9.440 11.297 2.779 778 HH11 ARG 145 HH11 ARG 145 11.015 12.536 5.648 779 HH12 ARG 145 HH12 ARG 145 12.592 11.992 5.172 780 HH21 ARG 145 HH21 ARG 145 11.504 10.581 2.146 781 HH22 ARG 145 HH22 ARG 145 12.874 10.891 3.168 782 H VAL 146 HN VAL 146 5.626 8.492 5.588 783 HA VAL 146 HA VAL 146 3.758 9.432 7.610 784 HB VAL 146 HB VAL 146 2.001 9.130 5.642 785 HG11 VAL 146 HG11 VAL 146 3.602 11.620 6.148 786 HG12 VAL 146 HG12 VAL 146 2.149 11.095 7.004 787 HG13 VAL 146 HG13 VAL 146 2.048 11.565 5.308 788 HG21 VAL 146 HG21 VAL 146 2.850 10.135 3.564 789 HG22 VAL 146 HG22 VAL 146 3.604 8.581 3.925 790 HG23 VAL 146 HG23 VAL 146 4.479 10.079 4.238 791 H ARG 147 HN ARG 147 3.795 7.548 8.724 792 HA ARG 147 HA ARG 147 4.412 5.163 7.294 793 HB2 ARG 147 HB2 ARG 147 4.520 4.147 9.624 794 HB3 ARG 147 HB1 ARG 147 5.705 5.372 9.202 795 HG2 ARG 147 HG2 ARG 147 4.746 5.586 11.487 796 HG3 ARG 147 HG1 ARG 147 4.561 7.027 10.481 797 HD2 ARG 147 HD2 ARG 147 2.310 6.627 10.110 798 HD3 ARG 147 HD1 ARG 147 2.439 4.945 10.592 799 HE ARG 147 HE ARG 147 3.060 6.384 12.851 800 HH11 ARG 147 HH11 ARG 147 0.337 6.202 10.668 801 HH12 ARG 147 HH12 ARG 147 -0.838 6.558 11.895 802 HH21 ARG 147 HH21 ARG 147 1.520 6.867 14.472 803 HH22 ARG 147 HH22 ARG 147 -0.162 6.961 14.057 804 H ILE 148 HN ILE 148 3.444 3.169 7.508 805 HA ILE 148 HA ILE 148 0.686 3.041 8.392 806 HB ILE 148 HB ILE 148 1.526 2.901 5.540 807 HG12 ILE 148 HG12 ILE 148 -0.946 3.858 6.961 808 HG13 ILE 148 HG11 ILE 148 0.332 4.853 6.292 809 HG21 ILE 148 HG21 ILE 148 0.746 0.701 5.731 810 HG22 ILE 148 HG22 ILE 148 -0.600 1.629 5.065 811 HG23 ILE 148 HG23 ILE 148 -0.590 1.184 6.774 812 HD11 ILE 148 HD11 ILE 148 -1.719 4.736 4.913 813 HD12 ILE 148 HD12 ILE 148 -1.377 3.026 4.655 814 HD13 ILE 148 HD13 ILE 148 -0.248 4.249 4.074 815 H SER 149 HN SER 149 0.461 1.126 9.438 816 HA SER 149 HA SER 149 2.170 -1.106 8.695 817 HB2 SER 149 HB2 SER 149 -0.066 -0.977 10.731 818 HB3 SER 149 HB1 SER 149 1.085 -2.294 10.540 819 HG SER 149 HG SER 149 2.667 -0.384 10.859 820 H ALA 150 HN ALA 150 1.466 -2.832 7.481 821 HA ALA 150 HA ALA 150 -0.355 -2.426 5.489 822 HB1 ALA 150 HB1 ALA 150 1.307 -4.237 5.510 823 HB2 ALA 150 HB2 ALA 150 -0.297 -4.811 5.059 824 HB3 ALA 150 HB3 ALA 150 0.322 -5.110 6.683 825 H ASP 151 HN ASP 151 -0.964 -4.425 8.360 826 HA ASP 151 HA ASP 151 -3.681 -4.901 7.975 827 HB2 ASP 151 HB2 ASP 151 -2.313 -6.048 9.671 828 HB3 ASP 151 HB1 ASP 151 -2.188 -4.534 10.576 829 H ALA 152 HN ALA 152 -2.107 -2.372 9.889 830 HA ALA 152 HA ALA 152 -4.269 -1.206 11.075 831 HB1 ALA 152 HB1 ALA 152 -2.918 0.766 11.325 832 HB2 ALA 152 HB2 ALA 152 -1.876 0.260 9.990 833 HB3 ALA 152 HB3 ALA 152 -1.905 -0.670 11.492 834 H MET 153 HN MET 153 -2.831 -0.366 7.998 835 HA MET 153 HA MET 153 -4.791 1.582 7.225 836 HB2 MET 153 HB2 MET 153 -2.503 1.683 6.492 837 HB3 MET 153 HB1 MET 153 -2.626 0.091 5.764 838 HG2 MET 153 HG2 MET 153 -4.509 1.203 4.364 839 HG3 MET 153 HG1 MET 153 -3.690 2.694 4.838 840 HE1 MET 153 HE1 MET 153 -1.937 -0.699 2.308 841 HE2 MET 153 HE2 MET 153 -3.561 -0.636 2.992 842 HE3 MET 153 HE3 MET 153 -2.171 -0.926 4.035 843 H MET 154 HN MET 154 -4.106 -1.777 6.278 844 HA MET 154 HA MET 154 -6.085 -1.983 4.321 845 HB2 MET 154 HB2 MET 154 -4.217 -3.689 5.614 846 HB3 MET 154 HB1 MET 154 -5.770 -4.507 5.612 847 HG2 MET 154 HG2 MET 154 -5.910 -4.073 3.162 848 HG3 MET 154 HG1 MET 154 -4.277 -3.412 3.244 849 HE1 MET 154 HE1 MET 154 -5.360 -7.816 4.090 850 HE2 MET 154 HE2 MET 154 -6.495 -6.649 3.412 851 HE3 MET 154 HE3 MET 154 -5.925 -6.463 5.073 852 H GLN 155 HN GLN 155 -6.207 -2.933 7.745 853 HA GLN 155 HA GLN 155 -8.854 -3.896 7.698 854 HB2 GLN 155 HB2 GLN 155 -7.270 -4.493 9.447 855 HB3 GLN 155 HB1 GLN 155 -7.210 -2.826 9.990 856 HG2 GLN 155 HG2 GLN 155 -9.542 -2.939 10.619 857 HG3 GLN 155 HG1 GLN 155 -9.612 -4.618 10.078 858 HE21 GLN 155 HE21 GLN 155 -8.318 -2.419 12.459 859 HE22 GLN 155 HE22 GLN 155 -7.894 -3.622 13.627 860 H ALA 156 HN ALA 156 -7.501 -0.721 8.027 861 HA ALA 156 HA ALA 156 -9.569 0.747 9.114 862 HB1 ALA 156 HB1 ALA 156 -7.904 1.642 6.766 863 HB2 ALA 156 HB2 ALA 156 -7.324 1.606 8.430 864 HB3 ALA 156 HB3 ALA 156 -8.672 2.655 7.992 865 H LEU 157 HN LEU 157 -9.030 0.057 5.695 866 HA LEU 157 HA LEU 157 -11.665 1.034 4.966 867 HB2 LEU 157 HB2 LEU 157 -10.243 -0.229 2.844 868 HB3 LEU 157 HB1 LEU 157 -10.676 1.436 3.008 869 HG LEU 157 HG LEU 157 -8.546 1.239 4.671 870 HD11 LEU 157 HD11 LEU 157 -8.287 -0.632 2.378 871 HD12 LEU 157 HD12 LEU 157 -7.951 -0.931 4.085 872 HD13 LEU 157 HD13 LEU 157 -6.880 0.106 3.136 873 HD21 LEU 157 HD21 LEU 157 -9.015 2.974 3.016 874 HD22 LEU 157 HD22 LEU 157 -8.512 1.864 1.738 875 HD23 LEU 157 HD23 LEU 157 -7.350 2.408 2.962 876 H LEU 158 HN LEU 158 -9.884 -1.969 5.081 877 HA LEU 158 HA LEU 158 -11.527 -3.532 3.458 878 HB2 LEU 158 HB2 LEU 158 -9.203 -3.991 4.123 879 HB3 LEU 158 HB1 LEU 158 -9.801 -4.431 5.672 880 HG LEU 158 HG LEU 158 -11.113 -6.204 4.566 881 HD11 LEU 158 HD11 LEU 158 -11.129 -5.290 2.356 882 HD12 LEU 158 HD12 LEU 158 -10.345 -6.873 2.342 883 HD13 LEU 158 HD13 LEU 158 -9.374 -5.399 2.280 884 HD21 LEU 158 HD21 LEU 158 -8.125 -6.162 4.534 885 HD22 LEU 158 HD22 LEU 158 -9.047 -7.614 4.139 886 HD23 LEU 158 HD23 LEU 158 -9.203 -6.877 5.733 887 H GLY 159 HN GLY 159 -11.966 -2.508 6.687 888 HA2 GLY 159 HA2 GLY 159 -13.699 -2.833 8.148 889 HA3 GLY 159 HA1 GLY 159 -14.552 -3.621 6.834 890 H ALA 160 HN ALA 160 -11.498 -4.896 7.504 891 HA ALA 160 HA ALA 160 -10.754 -6.875 8.271 892 HB1 ALA 160 HB1 ALA 160 -12.982 -6.705 10.293 893 HB2 ALA 160 HB2 ALA 160 -11.438 -5.864 10.433 894 HB3 ALA 160 HB3 ALA 160 -11.483 -7.626 10.424 895 H ARG 161 HN ARG 161 -12.668 -6.908 6.121 896 HA ARG 161 HA ARG 161 -14.355 -9.199 6.458 897 HB2 ARG 161 HB2 ARG 161 -14.548 -9.144 3.974 898 HB3 ARG 161 HB1 ARG 161 -14.943 -7.613 4.737 899 HG2 ARG 161 HG2 ARG 161 -13.029 -6.580 3.962 900 HG3 ARG 161 HG1 ARG 161 -12.182 -8.109 3.715 901 HD2 ARG 161 HD2 ARG 161 -14.634 -7.436 2.142 902 HD3 ARG 161 HD1 ARG 161 -13.055 -6.817 1.658 903 HE ARG 161 HE ARG 161 -12.320 -9.154 1.484 904 HH11 ARG 161 HH11 ARG 161 -15.773 -8.527 1.459 905 HH12 ARG 161 HH12 ARG 161 -16.143 -10.000 0.625 906 HH21 ARG 161 HH21 ARG 161 -12.802 -11.058 0.399 907 HH22 ARG 161 HH22 ARG 161 -14.458 -11.447 0.019 908 H ALA 162 HN ALA 162 -11.090 -8.956 6.414 909 HA ALA 162 HA ALA 162 -10.249 -10.914 4.586 910 HB1 ALA 162 HB1 ALA 162 -8.145 -10.924 5.816 911 HB2 ALA 162 HB2 ALA 162 -8.915 -10.071 7.154 912 HB3 ALA 162 HB3 ALA 162 -8.732 -9.276 5.592 913 H LYS 163 HN LYS 163 -11.516 -11.183 7.820 914 HA LYS 163 HA LYS 163 -11.297 -14.100 7.557 915 HB2 LYS 163 HB2 LYS 163 -10.711 -14.401 9.803 916 HB3 LYS 163 HB1 LYS 163 -9.702 -13.065 9.293 917 HG2 LYS 163 HG2 LYS 163 -12.263 -12.847 10.843 918 HG3 LYS 163 HG1 LYS 163 -10.647 -12.814 11.538 919 HD2 LYS 163 HD2 LYS 163 -10.190 -10.725 10.706 920 HD3 LYS 163 HD1 LYS 163 -11.369 -10.870 9.398 921 HE2 LYS 163 HE2 LYS 163 -12.254 -9.354 11.008 922 HE3 LYS 163 HE1 LYS 163 -13.155 -10.867 11.099 923 HZ1 LYS 163 HZ1 LYS 163 -11.906 -11.490 13.043 924 HZ2 LYS 163 HZ2 LYS 163 -12.617 -9.979 13.297 925 HZ3 LYS 163 HZ3 LYS 163 -10.966 -10.085 12.947 926 H GLY 164 HN GLY 164 -13.390 -11.935 7.099 927 HA2 GLY 164 HA2 GLY 164 -15.502 -13.154 8.761 928 HA3 GLY 164 HA1 GLY 164 -15.488 -11.439 8.371 929 H HIS 165 HN HIS 165 -16.664 -14.429 7.491 930 HA HIS 165 HA HIS 165 -16.811 -14.101 4.661 931 HB2 HIS 165 HB2 HIS 165 -16.943 -16.305 5.793 932 HB3 HIS 165 HB1 HIS 165 -18.491 -15.840 6.483 933 HD1 HIS 165 HD1 HIS 165 -16.924 -17.178 3.413 934 HD2 HIS 165 HD2 HIS 165 -20.636 -15.728 4.595 935 HE1 HIS 165 HE1 HIS 165 -18.539 -17.908 1.627 936 HE2 HIS 165 HE2 HIS 165 -20.798 -17.161 2.452 937 HAB 9XG 201 HAB DRG 201 5.094 5.277 5.104 938 HAC 9XG 201 HAC DRG 201 6.190 3.894 5.349 939 HAA 9XG 201 HAA DRG 201 4.477 3.767 5.818 940 HAD 9XG 201 HAD DRG 201 -0.411 2.146 -2.683 941 HAE 9XG 201 HAE DRG 201 1.718 3.422 -2.527 942 HAF 9XG 201 HAF DRG 201 -1.396 1.150 -0.636 943 HAG 9XG 201 HAG DRG 201 6.339 2.868 0.885 944 HAH 9XG 201 HAH DRG 201 6.905 3.737 3.142 945 HAI 9XG 201 HAI DRG 201 2.873 3.648 -0.364 946 HAJ 9XG 201 HAJ DRG 201 -0.256 1.407 1.546 947 HAK 9XG 201 HAK DRG 201 3.987 2.363 0.306 948 HAL 9XG 201 HAL DRG 201 2.749 3.611 4.224 949 HAM 9XG 201 HAM DRG 201 1.327 2.656 2.708 Start of MODEL 7 1 H1 MET 1 HT1 MET 1 11.141 -0.710 -7.343 2 H2 MET 1 HT2 MET 1 10.004 -0.262 -8.512 3 H3 MET 1 HT3 MET 1 11.208 -1.386 -8.891 4 HA MET 1 HA MET 1 9.054 -1.782 -6.903 5 HB2 MET 1 HB2 MET 1 8.409 -1.808 -9.384 6 HB3 MET 1 HB1 MET 1 9.418 -3.241 -9.520 7 HG2 MET 1 HG2 MET 1 7.160 -3.962 -9.222 8 HG3 MET 1 HG1 MET 1 8.048 -4.296 -7.738 9 HE1 MET 1 HE1 MET 1 4.696 -3.748 -8.491 10 HE2 MET 1 HE2 MET 1 4.289 -3.308 -6.831 11 HE3 MET 1 HE3 MET 1 5.385 -4.654 -7.144 12 H ASP 2 HN ASP 2 9.684 -3.145 -5.369 13 HA ASP 2 HA ASP 2 12.034 -4.724 -5.535 14 HB2 ASP 2 HB2 ASP 2 9.733 -4.783 -3.620 15 HB3 ASP 2 HB1 ASP 2 11.155 -5.798 -3.444 16 H ASP 3 HN ASP 3 12.179 -6.392 -6.910 17 HA ASP 3 HA ASP 3 9.817 -7.714 -7.802 18 HB2 ASP 3 HB2 ASP 3 11.303 -9.140 -9.145 19 HB3 ASP 3 HB1 ASP 3 11.575 -7.428 -9.390 20 H ILE 4 HN ILE 4 11.842 -8.124 -5.162 21 HA ILE 4 HA ILE 4 11.439 -10.892 -4.758 22 HB ILE 4 HB ILE 4 13.176 -9.669 -3.543 23 HG12 ILE 4 HG12 ILE 4 11.892 -11.733 -2.549 24 HG13 ILE 4 HG11 ILE 4 13.067 -10.866 -1.570 25 HG21 ILE 4 HG21 ILE 4 12.613 -8.159 -1.698 26 HG22 ILE 4 HG22 ILE 4 10.910 -8.289 -2.144 27 HG23 ILE 4 HG23 ILE 4 12.060 -7.561 -3.262 28 HD11 ILE 4 HD11 ILE 4 10.084 -10.507 -1.465 29 HD12 ILE 4 HD12 ILE 4 11.266 -9.664 -0.466 30 HD13 ILE 4 HD13 ILE 4 11.062 -11.408 -0.306 31 H TYR 5 HN TYR 5 9.669 -8.009 -3.652 32 HA TYR 5 HA TYR 5 7.558 -9.636 -2.554 33 HB2 TYR 5 HB2 TYR 5 7.836 -6.649 -2.859 34 HB3 TYR 5 HB1 TYR 5 6.405 -7.446 -2.192 35 HD1 TYR 5 HD1 TYR 5 9.792 -6.311 -1.405 36 HD2 TYR 5 HD2 TYR 5 6.611 -8.848 -0.195 37 HE1 TYR 5 HE1 TYR 5 10.753 -6.467 0.859 38 HE2 TYR 5 HE2 TYR 5 7.528 -8.987 2.028 39 HH TYR 5 HH TYR 5 9.603 -8.768 3.169 40 H LYS 6 HN LYS 6 8.256 -7.902 -5.467 41 HA LYS 6 HA LYS 6 5.827 -8.051 -6.778 42 HB2 LYS 6 HB2 LYS 6 8.004 -7.087 -7.569 43 HB3 LYS 6 HB1 LYS 6 8.396 -8.719 -8.108 44 HG2 LYS 6 HG2 LYS 6 6.484 -8.763 -9.534 45 HG3 LYS 6 HG1 LYS 6 5.925 -7.217 -8.920 46 HD2 LYS 6 HD2 LYS 6 7.768 -6.077 -9.837 47 HD3 LYS 6 HD1 LYS 6 8.574 -7.583 -10.269 48 HE2 LYS 6 HE2 LYS 6 6.999 -8.048 -11.972 49 HE3 LYS 6 HE1 LYS 6 5.905 -6.796 -11.396 50 HZ1 LYS 6 HZ1 LYS 6 7.390 -5.112 -12.148 51 HZ2 LYS 6 HZ2 LYS 6 7.188 -6.204 -13.423 52 HZ3 LYS 6 HZ3 LYS 6 8.602 -6.241 -12.497 53 H ALA 7 HN ALA 7 8.193 -10.555 -6.062 54 HA ALA 7 HA ALA 7 6.610 -12.682 -7.195 55 HB1 ALA 7 HB1 ALA 7 8.075 -14.147 -5.802 56 HB2 ALA 7 HB2 ALA 7 8.908 -12.688 -5.245 57 HB3 ALA 7 HB3 ALA 7 8.934 -13.123 -6.959 58 H ALA 8 HN ALA 8 7.058 -11.300 -3.949 59 HA ALA 8 HA ALA 8 5.822 -13.309 -2.496 60 HB1 ALA 8 HB1 ALA 8 5.490 -11.703 -0.758 61 HB2 ALA 8 HB2 ALA 8 5.726 -10.376 -1.895 62 HB3 ALA 8 HB3 ALA 8 7.066 -11.460 -1.514 63 H VAL 9 HN VAL 9 4.318 -10.610 -4.263 64 HA VAL 9 HA VAL 9 1.664 -11.247 -3.459 65 HB VAL 9 HB VAL 9 1.976 -9.105 -4.480 66 HG11 VAL 9 HG11 VAL 9 3.947 -9.532 -5.818 67 HG12 VAL 9 HG12 VAL 9 2.681 -8.848 -6.839 68 HG13 VAL 9 HG13 VAL 9 3.018 -10.579 -6.895 69 HG21 VAL 9 HG21 VAL 9 0.352 -9.129 -6.308 70 HG22 VAL 9 HG22 VAL 9 -0.164 -10.172 -4.975 71 HG23 VAL 9 HG23 VAL 9 0.521 -10.876 -6.438 72 H GLU 10 HN GLU 10 3.717 -12.404 -6.086 73 HA GLU 10 HA GLU 10 1.802 -14.059 -7.334 74 HB2 GLU 10 HB2 GLU 10 4.755 -14.537 -7.287 75 HB3 GLU 10 HB1 GLU 10 3.620 -14.876 -8.595 76 HG2 GLU 10 HG2 GLU 10 3.270 -12.334 -8.576 77 HG3 GLU 10 HG1 GLU 10 4.744 -12.303 -7.683 78 H GLN 11 HN GLN 11 3.785 -14.146 -4.664 79 HA GLN 11 HA GLN 11 3.789 -16.962 -4.062 80 HB2 GLN 11 HB2 GLN 11 5.676 -15.388 -3.758 81 HB3 GLN 11 HB1 GLN 11 4.738 -14.644 -2.480 82 HG2 GLN 11 HG2 GLN 11 6.306 -16.281 -1.656 83 HG3 GLN 11 HG1 GLN 11 4.653 -16.645 -1.278 84 HE21 GLN 11 HE21 GLN 11 7.386 -17.501 -3.240 85 HE22 GLN 11 HE22 GLN 11 6.846 -19.083 -3.684 86 H LEU 12 HN LEU 12 1.752 -14.303 -3.555 87 HA LEU 12 HA LEU 12 0.631 -15.116 -1.057 88 HB2 LEU 12 HB2 LEU 12 -0.276 -13.144 -3.130 89 HB3 LEU 12 HB1 LEU 12 -1.119 -13.420 -1.654 90 HG LEU 12 HG LEU 12 1.668 -12.352 -1.888 91 HD11 LEU 12 HD11 LEU 12 -0.027 -10.774 -2.639 92 HD12 LEU 12 HD12 LEU 12 0.682 -10.252 -1.109 93 HD13 LEU 12 HD13 LEU 12 -0.922 -10.990 -1.138 94 HD21 LEU 12 HD21 LEU 12 1.344 -11.910 0.585 95 HD22 LEU 12 HD22 LEU 12 1.594 -13.590 0.117 96 HD23 LEU 12 HD23 LEU 12 -0.033 -13.021 0.522 97 H THR 13 HN THR 13 -1.391 -16.043 -0.721 98 HA THR 13 HA THR 13 -2.434 -17.709 -2.825 99 HB THR 13 HB THR 13 -4.073 -18.439 -1.214 100 HG1 THR 13 HG1 THR 13 -4.005 -17.488 0.952 101 HG21 THR 13 HG21 THR 13 -2.647 -19.276 0.596 102 HG22 THR 13 HG22 THR 13 -1.386 -18.141 0.110 103 HG23 THR 13 HG23 THR 13 -1.875 -19.441 -0.978 104 H GLU 14 HN GLU 14 -4.802 -17.643 -3.266 105 HA GLU 14 HA GLU 14 -5.565 -15.221 -4.422 106 HB2 GLU 14 HB2 GLU 14 -6.826 -16.792 -5.394 107 HB3 GLU 14 HB1 GLU 14 -6.667 -17.866 -4.012 108 HG2 GLU 14 HG2 GLU 14 -8.462 -16.834 -2.914 109 HG3 GLU 14 HG1 GLU 14 -8.535 -15.549 -4.098 110 H GLU 15 HN GLU 15 -6.606 -16.741 -1.431 111 HA GLU 15 HA GLU 15 -8.366 -14.952 -0.361 112 HB2 GLU 15 HB2 GLU 15 -6.129 -16.415 1.054 113 HB3 GLU 15 HB1 GLU 15 -7.487 -15.655 1.870 114 HG2 GLU 15 HG2 GLU 15 -7.717 -17.849 -0.158 115 HG3 GLU 15 HG1 GLU 15 -7.724 -18.091 1.589 116 H GLN 16 HN GLN 16 -4.834 -14.853 -0.029 117 HA GLN 16 HA GLN 16 -4.484 -12.605 1.466 118 HB2 GLN 16 HB2 GLN 16 -2.886 -13.626 -0.843 119 HB3 GLN 16 HB1 GLN 16 -2.273 -12.584 0.426 120 HG2 GLN 16 HG2 GLN 16 -3.569 -15.187 1.035 121 HG3 GLN 16 HG1 GLN 16 -1.901 -15.125 0.589 122 HE21 GLN 16 HE21 GLN 16 -3.178 -16.016 3.029 123 HE22 GLN 16 HE22 GLN 16 -2.512 -15.069 4.312 124 H LYS 17 HN LYS 17 -4.431 -12.778 -2.062 125 HA LYS 17 HA LYS 17 -4.116 -9.977 -2.336 126 HB2 LYS 17 HB2 LYS 17 -4.717 -12.127 -4.367 127 HB3 LYS 17 HB1 LYS 17 -4.359 -10.450 -4.767 128 HG2 LYS 17 HG2 LYS 17 -2.189 -10.623 -3.719 129 HG3 LYS 17 HG1 LYS 17 -2.546 -12.261 -3.197 130 HD2 LYS 17 HD2 LYS 17 -2.374 -11.408 -6.081 131 HD3 LYS 17 HD1 LYS 17 -1.040 -12.125 -5.166 132 HE2 LYS 17 HE2 LYS 17 -2.828 -13.979 -4.644 133 HE3 LYS 17 HE1 LYS 17 -3.567 -13.336 -6.103 134 HZ1 LYS 17 HZ1 LYS 17 -1.873 -15.255 -6.278 135 HZ2 LYS 17 HZ2 LYS 17 -0.721 -14.023 -6.149 136 HZ3 LYS 17 HZ3 LYS 17 -1.838 -14.009 -7.419 137 H ASN 18 HN ASN 18 -6.829 -12.057 -2.119 138 HA ASN 18 HA ASN 18 -8.840 -10.498 -3.251 139 HB2 ASN 18 HB2 ASN 18 -9.159 -12.806 -2.566 140 HB3 ASN 18 HB1 ASN 18 -8.883 -12.372 -0.889 141 HD21 ASN 18 HD21 ASN 18 -10.864 -13.291 -0.357 142 HD22 ASN 18 HD22 ASN 18 -12.354 -12.467 -0.662 143 H GLU 19 HN GLU 19 -7.742 -10.575 0.169 144 HA GLU 19 HA GLU 19 -9.375 -8.417 1.043 145 HB2 GLU 19 HB2 GLU 19 -7.758 -10.273 2.265 146 HB3 GLU 19 HB1 GLU 19 -6.862 -8.790 2.463 147 HG2 GLU 19 HG2 GLU 19 -8.612 -7.738 3.612 148 HG3 GLU 19 HG1 GLU 19 -9.747 -9.007 3.194 149 H PHE 20 HN PHE 20 -6.083 -8.653 -0.154 150 HA PHE 20 HA PHE 20 -5.386 -5.961 0.426 151 HB2 PHE 20 HB2 PHE 20 -4.112 -7.821 -1.589 152 HB3 PHE 20 HB1 PHE 20 -3.393 -6.377 -0.899 153 HD1 PHE 20 HD1 PHE 20 -4.489 -6.908 1.939 154 HD2 PHE 20 HD2 PHE 20 -2.377 -9.312 -0.848 155 HE1 PHE 20 HE1 PHE 20 -3.635 -8.265 3.788 156 HE2 PHE 20 HE2 PHE 20 -1.498 -10.676 1.011 157 HZ PHE 20 HZ PHE 20 -2.124 -10.157 3.323 158 H LYS 21 HN LYS 21 -6.718 -7.543 -2.438 159 HA LYS 21 HA LYS 21 -6.680 -5.383 -4.236 160 HB2 LYS 21 HB2 LYS 21 -7.616 -7.829 -4.476 161 HB3 LYS 21 HB1 LYS 21 -9.085 -7.079 -3.952 162 HG2 LYS 21 HG2 LYS 21 -7.545 -6.405 -6.432 163 HG3 LYS 21 HG1 LYS 21 -9.099 -7.218 -6.330 164 HD2 LYS 21 HD2 LYS 21 -8.658 -4.424 -5.356 165 HD3 LYS 21 HD1 LYS 21 -9.168 -4.808 -6.998 166 HE2 LYS 21 HE2 LYS 21 -10.612 -5.388 -4.424 167 HE3 LYS 21 HE1 LYS 21 -11.114 -4.334 -5.730 168 HZ1 LYS 21 HZ1 LYS 21 -10.863 -7.280 -5.942 169 HZ2 LYS 21 HZ2 LYS 21 -11.405 -6.243 -7.162 170 HZ3 LYS 21 HZ3 LYS 21 -12.314 -6.436 -5.748 171 H ALA 22 HN ALA 22 -9.064 -6.394 -1.859 172 HA ALA 22 HA ALA 22 -10.910 -4.446 -2.475 173 HB1 ALA 22 HB1 ALA 22 -11.963 -4.974 -0.339 174 HB2 ALA 22 HB2 ALA 22 -10.496 -5.805 0.181 175 HB3 ALA 22 HB3 ALA 22 -11.439 -6.438 -1.170 176 H ALA 23 HN ALA 23 -8.233 -4.461 -0.188 177 HA ALA 23 HA ALA 23 -8.591 -1.955 0.966 178 HB1 ALA 23 HB1 ALA 23 -6.261 -1.993 1.506 179 HB2 ALA 23 HB2 ALA 23 -5.943 -3.180 0.239 180 HB3 ALA 23 HB3 ALA 23 -6.892 -3.633 1.653 181 H PHE 24 HN PHE 24 -6.610 -2.774 -1.900 182 HA PHE 24 HA PHE 24 -5.967 -0.276 -2.844 183 HB2 PHE 24 HB2 PHE 24 -5.302 -2.346 -3.960 184 HB3 PHE 24 HB1 PHE 24 -6.948 -2.644 -4.399 185 HD1 PHE 24 HD1 PHE 24 -4.649 0.276 -4.737 186 HD2 PHE 24 HD2 PHE 24 -7.369 -2.390 -6.644 187 HE1 PHE 24 HE1 PHE 24 -4.368 1.498 -6.845 188 HE2 PHE 24 HE2 PHE 24 -7.086 -1.170 -8.757 189 HZ PHE 24 HZ PHE 24 -5.584 0.780 -8.857 190 H ASP 25 HN ASP 25 -8.669 -2.170 -3.749 191 HA ASP 25 HA ASP 25 -10.183 -0.555 -5.313 192 HB2 ASP 25 HB2 ASP 25 -10.644 -2.941 -4.638 193 HB3 ASP 25 HB1 ASP 25 -11.326 -2.311 -3.173 194 H ILE 26 HN ILE 26 -10.593 -0.679 -1.726 195 HA ILE 26 HA ILE 26 -12.484 1.472 -1.828 196 HB ILE 26 HB ILE 26 -11.098 0.372 0.589 197 HG12 ILE 26 HG12 ILE 26 -13.872 -0.386 -0.072 198 HG13 ILE 26 HG11 ILE 26 -12.615 -1.077 -1.081 199 HG21 ILE 26 HG21 ILE 26 -13.648 1.945 0.291 200 HG22 ILE 26 HG22 ILE 26 -12.118 2.548 0.931 201 HG23 ILE 26 HG23 ILE 26 -12.999 1.291 1.799 202 HD11 ILE 26 HD11 ILE 26 -11.642 -2.219 0.652 203 HD12 ILE 26 HD12 ILE 26 -13.368 -2.371 1.006 204 HD13 ILE 26 HD13 ILE 26 -12.382 -1.192 1.883 205 H PHE 27 HN PHE 27 -9.055 1.195 -1.109 206 HA PHE 27 HA PHE 27 -8.379 3.716 -0.233 207 HB2 PHE 27 HB2 PHE 27 -7.143 1.613 -1.859 208 HB3 PHE 27 HB1 PHE 27 -6.520 3.209 -2.162 209 HD1 PHE 27 HD1 PHE 27 -5.213 4.382 -0.533 210 HD2 PHE 27 HD2 PHE 27 -6.773 0.506 0.236 211 HE1 PHE 27 HE1 PHE 27 -3.692 4.125 1.381 212 HE2 PHE 27 HE2 PHE 27 -5.251 0.275 2.153 213 HZ PHE 27 HZ PHE 27 -3.709 2.098 2.716 214 H VAL 28 HN VAL 28 -9.166 2.589 -3.419 215 HA VAL 28 HA VAL 28 -8.885 5.244 -4.594 216 HB VAL 28 HB VAL 28 -8.933 4.098 -6.750 217 HG11 VAL 28 HG11 VAL 28 -6.837 4.278 -5.279 218 HG12 VAL 28 HG12 VAL 28 -6.804 3.155 -6.633 219 HG13 VAL 28 HG13 VAL 28 -7.062 2.548 -5.002 220 HG21 VAL 28 HG21 VAL 28 -10.453 2.267 -6.280 221 HG22 VAL 28 HG22 VAL 28 -9.328 1.588 -5.099 222 HG23 VAL 28 HG23 VAL 28 -8.911 1.601 -6.812 223 H LEU 29 HN LEU 29 -11.242 3.506 -3.146 224 HA LEU 29 HA LEU 29 -13.424 3.730 -4.887 225 HB2 LEU 29 HB2 LEU 29 -13.455 2.351 -2.936 226 HB3 LEU 29 HB1 LEU 29 -13.240 3.727 -1.893 227 HG LEU 29 HG LEU 29 -15.630 4.007 -3.459 228 HD11 LEU 29 HD11 LEU 29 -15.577 1.564 -3.498 229 HD12 LEU 29 HD12 LEU 29 -16.865 2.149 -2.442 230 HD13 LEU 29 HD13 LEU 29 -15.359 1.541 -1.746 231 HD21 LEU 29 HD21 LEU 29 -15.206 5.269 -1.447 232 HD22 LEU 29 HD22 LEU 29 -15.016 3.782 -0.521 233 HD23 LEU 29 HD23 LEU 29 -16.592 4.215 -1.181 234 H GLY 30 HN GLY 30 -14.368 5.465 -5.683 235 HA2 GLY 30 HA2 GLY 30 -15.344 7.639 -5.513 236 HA3 GLY 30 HA1 GLY 30 -14.236 8.000 -4.194 237 H ALA 31 HN ALA 31 -12.258 6.480 -6.141 238 HA ALA 31 HA ALA 31 -11.258 8.901 -7.386 239 HB1 ALA 31 HB1 ALA 31 -9.671 7.364 -6.328 240 HB2 ALA 31 HB2 ALA 31 -9.342 7.530 -8.052 241 HB3 ALA 31 HB3 ALA 31 -10.156 6.088 -7.447 242 H GLU 32 HN GLU 32 -10.939 9.171 -9.572 243 HA GLU 32 HA GLU 32 -12.979 8.006 -11.223 244 HB2 GLU 32 HB2 GLU 32 -12.440 10.375 -11.382 245 HB3 GLU 32 HB1 GLU 32 -10.784 9.991 -11.823 246 HG2 GLU 32 HG2 GLU 32 -11.546 8.990 -13.898 247 HG3 GLU 32 HG1 GLU 32 -13.223 9.309 -13.446 248 H ASP 33 HN ASP 33 -9.441 7.974 -11.116 249 HA ASP 33 HA ASP 33 -9.250 6.218 -13.383 250 HB2 ASP 33 HB2 ASP 33 -7.543 7.949 -12.904 251 HB3 ASP 33 HB1 ASP 33 -7.111 7.057 -11.456 252 H GLY 34 HN GLY 34 -9.706 5.872 -10.063 253 HA2 GLY 34 HA2 GLY 34 -9.902 4.073 -8.690 254 HA3 GLY 34 HA1 GLY 34 -10.013 3.123 -10.147 255 H SER 35 HN SER 35 -7.217 5.042 -9.394 256 HA SER 35 HA SER 35 -5.799 2.784 -8.229 257 HB2 SER 35 HB2 SER 35 -4.750 4.254 -10.662 258 HB3 SER 35 HB1 SER 35 -3.848 3.089 -9.714 259 HG SER 35 HG SER 35 -6.114 1.934 -10.319 260 H ILE 36 HN ILE 36 -3.881 3.559 -7.005 261 HA ILE 36 HA ILE 36 -4.953 5.775 -5.523 262 HB ILE 36 HB ILE 36 -2.524 4.062 -5.035 263 HG12 ILE 36 HG12 ILE 36 -5.180 4.122 -3.601 264 HG13 ILE 36 HG11 ILE 36 -4.754 2.943 -4.842 265 HG21 ILE 36 HG21 ILE 36 -3.035 6.582 -3.986 266 HG22 ILE 36 HG22 ILE 36 -1.891 5.392 -3.380 267 HG23 ILE 36 HG23 ILE 36 -3.520 5.462 -2.715 268 HD11 ILE 36 HD11 ILE 36 -3.428 3.312 -2.172 269 HD12 ILE 36 HD12 ILE 36 -2.905 2.174 -3.413 270 HD13 ILE 36 HD13 ILE 36 -4.489 1.988 -2.661 271 H SER 37 HN SER 37 -4.603 7.698 -6.493 272 HA SER 37 HA SER 37 -1.885 8.607 -6.863 273 HB2 SER 37 HB2 SER 37 -4.016 10.572 -6.569 274 HB3 SER 37 HB1 SER 37 -2.816 10.423 -7.828 275 HG SER 37 HG SER 37 -5.378 9.362 -7.652 276 H THR 38 HN THR 38 -1.329 10.700 -5.459 277 HA THR 38 HA THR 38 -0.865 9.596 -2.945 278 HB THR 38 HB THR 38 -0.078 11.857 -2.277 279 HG1 THR 38 HG1 THR 38 -0.144 13.055 -4.657 280 HG21 THR 38 HG21 THR 38 1.463 10.408 -3.369 281 HG22 THR 38 HG22 THR 38 1.661 12.006 -4.092 282 HG23 THR 38 HG23 THR 38 0.767 10.748 -4.952 283 H LYS 39 HN LYS 39 -3.477 11.760 -3.962 284 HA LYS 39 HA LYS 39 -4.280 12.123 -1.226 285 HB2 LYS 39 HB2 LYS 39 -4.595 13.820 -3.086 286 HB3 LYS 39 HB1 LYS 39 -5.999 12.854 -3.502 287 HG2 LYS 39 HG2 LYS 39 -6.233 14.849 -1.872 288 HG3 LYS 39 HG1 LYS 39 -7.132 13.370 -1.579 289 HD2 LYS 39 HD2 LYS 39 -5.427 12.677 0.039 290 HD3 LYS 39 HD1 LYS 39 -4.513 14.153 -0.282 291 HE2 LYS 39 HE2 LYS 39 -7.317 14.030 0.827 292 HE3 LYS 39 HE1 LYS 39 -5.855 14.273 1.783 293 HZ1 LYS 39 HZ1 LYS 39 -5.444 16.307 0.492 294 HZ2 LYS 39 HZ2 LYS 39 -6.892 16.371 1.351 295 HZ3 LYS 39 HZ3 LYS 39 -6.914 16.087 -0.310 296 H GLU 40 HN GLU 40 -5.112 9.936 -3.825 297 HA GLU 40 HA GLU 40 -7.431 8.802 -2.685 298 HB2 GLU 40 HB2 GLU 40 -5.266 7.786 -4.495 299 HB3 GLU 40 HB1 GLU 40 -6.353 6.620 -3.761 300 HG2 GLU 40 HG2 GLU 40 -7.016 7.315 -6.038 301 HG3 GLU 40 HG1 GLU 40 -8.245 7.608 -4.814 302 H LEU 41 HN LEU 41 -4.025 8.083 -2.340 303 HA LEU 41 HA LEU 41 -4.158 6.171 -0.292 304 HB2 LEU 41 HB2 LEU 41 -2.192 6.950 -1.827 305 HB3 LEU 41 HB1 LEU 41 -1.963 8.224 -0.681 306 HG LEU 41 HG LEU 41 -0.457 6.802 0.179 307 HD11 LEU 41 HD11 LEU 41 -2.021 6.885 1.960 308 HD12 LEU 41 HD12 LEU 41 -1.416 5.231 1.860 309 HD13 LEU 41 HD13 LEU 41 -2.999 5.642 1.217 310 HD21 LEU 41 HD21 LEU 41 -0.347 4.489 -0.251 311 HD22 LEU 41 HD22 LEU 41 -0.810 5.279 -1.758 312 HD23 LEU 41 HD23 LEU 41 -2.023 4.439 -0.788 313 H GLY 42 HN GLY 42 -3.519 9.678 -0.176 314 HA2 GLY 42 HA2 GLY 42 -3.392 10.129 2.513 315 HA3 GLY 42 HA1 GLY 42 -3.996 11.296 1.362 316 H LYS 43 HN LYS 43 -6.296 10.020 0.493 317 HA LYS 43 HA LYS 43 -8.333 10.563 2.236 318 HB2 LYS 43 HB2 LYS 43 -8.874 10.098 0.010 319 HB3 LYS 43 HB1 LYS 43 -8.057 8.539 0.041 320 HG2 LYS 43 HG2 LYS 43 -10.031 8.386 2.000 321 HG3 LYS 43 HG1 LYS 43 -10.764 9.197 0.617 322 HD2 LYS 43 HD2 LYS 43 -10.066 7.413 -0.859 323 HD3 LYS 43 HD1 LYS 43 -9.202 6.622 0.459 324 HE2 LYS 43 HE2 LYS 43 -11.230 5.444 0.209 325 HE3 LYS 43 HE1 LYS 43 -11.434 6.460 1.637 326 HZ1 LYS 43 HZ1 LYS 43 -12.629 8.060 0.283 327 HZ2 LYS 43 HZ2 LYS 43 -13.377 6.547 0.202 328 HZ3 LYS 43 HZ3 LYS 43 -12.429 7.093 -1.088 329 H VAL 44 HN VAL 44 -7.001 7.293 1.719 330 HA VAL 44 HA VAL 44 -8.426 6.103 3.858 331 HB VAL 44 HB VAL 44 -6.052 5.258 2.201 332 HG11 VAL 44 HG11 VAL 44 -7.030 3.841 4.705 333 HG12 VAL 44 HG12 VAL 44 -5.409 4.471 4.403 334 HG13 VAL 44 HG13 VAL 44 -6.004 3.092 3.481 335 HG21 VAL 44 HG21 VAL 44 -8.784 4.075 2.749 336 HG22 VAL 44 HG22 VAL 44 -7.588 3.411 1.628 337 HG23 VAL 44 HG23 VAL 44 -8.313 4.991 1.316 338 H MET 45 HN MET 45 -5.249 7.585 3.621 339 HA MET 45 HA MET 45 -4.211 6.792 6.076 340 HB2 MET 45 HB2 MET 45 -3.833 9.451 4.710 341 HB3 MET 45 HB1 MET 45 -2.760 8.715 5.899 342 HG2 MET 45 HG2 MET 45 -3.420 7.343 3.365 343 HG3 MET 45 HG1 MET 45 -2.146 8.523 3.453 344 HE1 MET 45 HE1 MET 45 -0.629 8.492 5.642 345 HE2 MET 45 HE2 MET 45 0.130 8.110 4.083 346 HE3 MET 45 HE3 MET 45 0.523 7.152 5.512 347 H ARG 46 HN ARG 46 -6.318 9.525 5.236 348 HA ARG 46 HA ARG 46 -6.377 10.619 7.839 349 HB2 ARG 46 HB2 ARG 46 -7.619 11.059 5.239 350 HB3 ARG 46 HB1 ARG 46 -8.668 11.444 6.581 351 HG2 ARG 46 HG2 ARG 46 -7.549 13.448 6.216 352 HG3 ARG 46 HG1 ARG 46 -6.627 12.731 7.506 353 HD2 ARG 46 HD2 ARG 46 -4.928 12.060 6.014 354 HD3 ARG 46 HD1 ARG 46 -5.897 12.457 4.604 355 HE ARG 46 HE ARG 46 -5.357 14.653 6.423 356 HH11 ARG 46 HH11 ARG 46 -4.388 13.002 3.499 357 HH12 ARG 46 HH12 ARG 46 -3.532 14.370 2.862 358 HH21 ARG 46 HH21 ARG 46 -4.262 16.454 5.585 359 HH22 ARG 46 HH22 ARG 46 -3.469 16.337 4.044 360 H MET 47 HN MET 47 -8.123 8.126 6.186 361 HA MET 47 HA MET 47 -10.179 7.685 8.039 362 HB2 MET 47 HB2 MET 47 -8.833 6.220 5.829 363 HB3 MET 47 HB1 MET 47 -10.022 5.412 6.790 364 HG2 MET 47 HG2 MET 47 -11.727 6.828 6.071 365 HG3 MET 47 HG1 MET 47 -10.589 8.016 5.464 366 HE1 MET 47 HE1 MET 47 -10.457 4.083 4.907 367 HE2 MET 47 HE2 MET 47 -11.439 3.951 3.448 368 HE3 MET 47 HE3 MET 47 -12.173 4.484 4.960 369 H LEU 48 HN LEU 48 -6.802 7.082 8.067 370 HA LEU 48 HA LEU 48 -6.950 4.954 10.068 371 HB2 LEU 48 HB2 LEU 48 -4.407 6.148 9.206 372 HB3 LEU 48 HB1 LEU 48 -4.740 4.509 9.682 373 HG LEU 48 HG LEU 48 -5.622 5.721 7.075 374 HD11 LEU 48 HD11 LEU 48 -3.787 4.585 6.042 375 HD12 LEU 48 HD12 LEU 48 -3.313 3.857 7.573 376 HD13 LEU 48 HD13 LEU 48 -3.152 5.596 7.336 377 HD21 LEU 48 HD21 LEU 48 -5.629 2.903 8.134 378 HD22 LEU 48 HD22 LEU 48 -5.917 3.337 6.448 379 HD23 LEU 48 HD23 LEU 48 -7.025 3.890 7.705 380 H GLY 49 HN GLY 49 -6.794 8.309 9.938 381 HA2 GLY 49 HA2 GLY 49 -6.681 9.682 11.899 382 HA3 GLY 49 HA1 GLY 49 -5.645 8.468 12.636 383 H GLN 50 HN GLN 50 -4.670 8.728 9.534 384 HA GLN 50 HA GLN 50 -2.347 10.344 10.233 385 HB2 GLN 50 HB2 GLN 50 -3.003 8.843 7.690 386 HB3 GLN 50 HB1 GLN 50 -1.455 9.578 8.069 387 HG2 GLN 50 HG2 GLN 50 -2.720 7.259 9.524 388 HG3 GLN 50 HG1 GLN 50 -1.408 7.146 8.361 389 HE21 GLN 50 HE21 GLN 50 -1.433 6.273 11.080 390 HE22 GLN 50 HE22 GLN 50 -0.192 7.140 11.913 391 H ASN 51 HN ASN 51 -1.764 12.241 9.001 392 HA ASN 51 HA ASN 51 -3.835 13.227 7.127 393 HB2 ASN 51 HB2 ASN 51 -3.426 15.557 8.029 394 HB3 ASN 51 HB1 ASN 51 -4.290 14.485 9.122 395 HD21 ASN 51 HD21 ASN 51 -3.383 13.942 11.057 396 HD22 ASN 51 HD22 ASN 51 -1.926 14.648 11.659 397 HA PRO 52 HA PRO 52 0.677 12.952 5.707 398 HB2 PRO 52 HB2 PRO 52 -0.113 12.288 3.123 399 HB3 PRO 52 HB1 PRO 52 0.512 11.210 4.341 400 HG2 PRO 52 HG2 PRO 52 -2.244 11.625 3.431 401 HG3 PRO 52 HG1 PRO 52 -1.530 10.213 4.205 402 HD2 PRO 52 HD2 PRO 52 -3.232 11.931 5.423 403 HD3 PRO 52 HD1 PRO 52 -2.066 10.917 6.266 404 H THR 53 HN THR 53 1.855 14.060 4.198 405 HA THR 53 HA THR 53 0.403 15.968 2.530 406 HB THR 53 HB THR 53 2.690 16.867 1.987 407 HG1 THR 53 HG1 THR 53 3.444 14.988 4.009 408 HG21 THR 53 HG21 THR 53 1.394 17.992 3.699 409 HG22 THR 53 HG22 THR 53 3.100 17.962 4.146 410 HG23 THR 53 HG23 THR 53 1.968 16.851 4.916 411 HA PRO 54 HA PRO 54 1.008 13.543 -1.192 412 HB2 PRO 54 HB2 PRO 54 1.953 16.170 -2.210 413 HB3 PRO 54 HB1 PRO 54 0.879 15.000 -2.974 414 HG2 PRO 54 HG2 PRO 54 -0.152 17.094 -1.833 415 HG3 PRO 54 HG1 PRO 54 -0.865 15.524 -1.533 416 HD2 PRO 54 HD2 PRO 54 0.907 17.157 0.226 417 HD3 PRO 54 HD1 PRO 54 -0.532 16.206 0.655 418 H GLU 55 HN GLU 55 3.354 15.613 0.223 419 HA GLU 55 HA GLU 55 5.691 15.044 -1.140 420 HB2 GLU 55 HB2 GLU 55 5.172 16.726 0.682 421 HB3 GLU 55 HB1 GLU 55 5.622 15.456 1.795 422 HG2 GLU 55 HG2 GLU 55 7.449 16.900 1.280 423 HG3 GLU 55 HG1 GLU 55 7.716 15.289 0.701 424 H GLU 56 HN GLU 56 4.457 13.480 1.802 425 HA GLU 56 HA GLU 56 6.456 11.416 1.672 426 HB2 GLU 56 HB2 GLU 56 5.143 10.453 3.568 427 HB3 GLU 56 HB1 GLU 56 5.689 12.097 3.844 428 HG2 GLU 56 HG2 GLU 56 3.368 12.705 2.930 429 HG3 GLU 56 HG1 GLU 56 2.950 11.055 3.322 430 H LEU 57 HN LEU 57 3.064 11.786 0.937 431 HA LEU 57 HA LEU 57 2.292 9.164 0.480 432 HB2 LEU 57 HB2 LEU 57 1.399 11.786 -0.633 433 HB3 LEU 57 HB1 LEU 57 0.584 10.296 -1.069 434 HG LEU 57 HG LEU 57 0.919 11.139 1.798 435 HD11 LEU 57 HD11 LEU 57 -0.228 12.991 0.920 436 HD12 LEU 57 HD12 LEU 57 -1.489 11.931 1.555 437 HD13 LEU 57 HD13 LEU 57 -1.176 11.988 -0.184 438 HD21 LEU 57 HD21 LEU 57 -1.264 9.519 0.553 439 HD22 LEU 57 HD22 LEU 57 -0.784 9.599 2.246 440 HD23 LEU 57 HD23 LEU 57 0.242 8.795 1.064 441 H GLN 58 HN GLN 58 3.619 11.534 -1.772 442 HA GLN 58 HA GLN 58 3.254 10.090 -4.126 443 HB2 GLN 58 HB2 GLN 58 3.833 12.528 -3.902 444 HB3 GLN 58 HB1 GLN 58 5.487 12.042 -3.567 445 HG2 GLN 58 HG2 GLN 58 5.714 11.087 -5.748 446 HG3 GLN 58 HG1 GLN 58 4.004 11.357 -6.091 447 HE21 GLN 58 HE21 GLN 58 5.942 13.665 -4.357 448 HE22 GLN 58 HE22 GLN 58 5.989 14.862 -5.603 449 H GLU 59 HN GLU 59 6.063 10.198 -1.953 450 HA GLU 59 HA GLU 59 7.724 8.721 -3.670 451 HB2 GLU 59 HB2 GLU 59 7.952 9.093 -0.741 452 HB3 GLU 59 HB1 GLU 59 9.247 8.625 -1.817 453 HG2 GLU 59 HG2 GLU 59 7.745 11.191 -2.148 454 HG3 GLU 59 HG1 GLU 59 9.144 11.059 -1.097 455 H MET 60 HN MET 60 5.566 7.697 -1.070 456 HA MET 60 HA MET 60 6.635 5.029 -1.120 457 HB2 MET 60 HB2 MET 60 4.954 4.465 0.475 458 HB3 MET 60 HB1 MET 60 5.691 5.981 0.928 459 HG2 MET 60 HG2 MET 60 3.666 7.081 -0.146 460 HG3 MET 60 HG1 MET 60 2.940 5.473 -0.126 461 HE1 MET 60 HE1 MET 60 1.510 7.872 1.705 462 HE2 MET 60 HE2 MET 60 0.980 6.570 2.759 463 HE3 MET 60 HE3 MET 60 1.103 6.308 1.018 464 H ILE 61 HN ILE 61 4.070 6.740 -2.691 465 HA ILE 61 HA ILE 61 2.926 4.454 -3.967 466 HB ILE 61 HB ILE 61 2.865 7.413 -4.529 467 HG12 ILE 61 HG12 ILE 61 0.821 5.407 -3.574 468 HG13 ILE 61 HG11 ILE 61 1.659 6.599 -2.587 469 HG21 ILE 61 HG21 ILE 61 1.232 5.414 -6.054 470 HG22 ILE 61 HG22 ILE 61 2.728 6.088 -6.684 471 HG23 ILE 61 HG23 ILE 61 1.357 7.144 -6.345 472 HD11 ILE 61 HD11 ILE 61 0.559 8.362 -3.978 473 HD12 ILE 61 HD12 ILE 61 -0.515 7.394 -2.969 474 HD13 ILE 61 HD13 ILE 61 -0.408 7.069 -4.699 475 H ASP 62 HN ASP 62 5.237 6.960 -4.942 476 HA ASP 62 HA ASP 62 5.889 6.067 -7.474 477 HB2 ASP 62 HB2 ASP 62 6.626 8.209 -6.390 478 HB3 ASP 62 HB1 ASP 62 7.804 7.277 -5.481 479 H GLU 63 HN GLU 63 7.043 4.972 -4.355 480 HA GLU 63 HA GLU 63 9.171 3.366 -4.981 481 HB2 GLU 63 HB2 GLU 63 8.518 3.658 -2.711 482 HB3 GLU 63 HB1 GLU 63 6.951 2.915 -3.000 483 HG2 GLU 63 HG2 GLU 63 8.151 1.266 -1.937 484 HG3 GLU 63 HG1 GLU 63 8.279 0.823 -3.631 485 H VAL 64 HN VAL 64 5.715 2.426 -5.144 486 HA VAL 64 HA VAL 64 6.592 -0.028 -6.470 487 HB VAL 64 HB VAL 64 4.239 -0.839 -6.123 488 HG11 VAL 64 HG11 VAL 64 5.886 -0.236 -3.669 489 HG12 VAL 64 HG12 VAL 64 6.134 -1.581 -4.776 490 HG13 VAL 64 HG13 VAL 64 4.656 -1.495 -3.820 491 HG21 VAL 64 HG21 VAL 64 3.013 1.088 -5.739 492 HG22 VAL 64 HG22 VAL 64 4.139 1.688 -4.515 493 HG23 VAL 64 HG23 VAL 64 3.094 0.310 -4.159 494 H ASP 65 HN ASP 65 4.844 2.891 -7.080 495 HA ASP 65 HA ASP 65 3.420 2.349 -9.399 496 HB2 ASP 65 HB2 ASP 65 3.210 4.493 -8.441 497 HB3 ASP 65 HB1 ASP 65 4.937 4.737 -8.403 498 H GLU 66 HN GLU 66 4.240 1.043 -11.007 499 HA GLU 66 HA GLU 66 7.049 1.199 -11.682 500 HB2 GLU 66 HB2 GLU 66 4.849 -0.605 -12.504 501 HB3 GLU 66 HB1 GLU 66 6.341 -0.611 -13.410 502 HG2 GLU 66 HG2 GLU 66 7.474 -1.037 -11.208 503 HG3 GLU 66 HG1 GLU 66 5.881 -1.319 -10.536 504 H ASP 67 HN ASP 67 4.001 2.072 -13.253 505 HA ASP 67 HA ASP 67 5.333 2.477 -15.796 506 HB2 ASP 67 HB2 ASP 67 2.975 1.601 -15.585 507 HB3 ASP 67 HB1 ASP 67 2.485 3.213 -15.082 508 H GLY 68 HN GLY 68 5.079 4.255 -13.012 509 HA2 GLY 68 HA2 GLY 68 5.896 6.371 -12.592 510 HA3 GLY 68 HA1 GLY 68 6.155 6.567 -14.319 511 H SER 69 HN SER 69 3.092 5.622 -12.973 512 HA SER 69 HA SER 69 1.758 7.811 -14.275 513 HB2 SER 69 HB2 SER 69 0.653 5.701 -12.395 514 HB3 SER 69 HB1 SER 69 -0.305 6.745 -13.458 515 HG SER 69 HG SER 69 1.010 4.427 -14.011 516 H GLY 70 HN GLY 70 3.103 7.224 -11.206 517 HA2 GLY 70 HA2 GLY 70 3.165 8.467 -9.260 518 HA3 GLY 70 HA1 GLY 70 2.172 9.686 -10.020 519 H THR 71 HN THR 71 0.936 6.682 -10.435 520 HA THR 71 HA THR 71 -0.753 6.841 -8.066 521 HB THR 71 HB THR 71 -2.703 6.172 -9.501 522 HG1 THR 71 HG1 THR 71 -1.258 5.525 -11.293 523 HG21 THR 71 HG21 THR 71 -1.424 8.861 -10.078 524 HG22 THR 71 HG22 THR 71 -2.605 8.489 -8.809 525 HG23 THR 71 HG23 THR 71 -3.076 8.429 -10.508 526 H VAL 72 HN VAL 72 -1.130 4.912 -7.174 527 HA VAL 72 HA VAL 72 0.327 2.639 -8.242 528 HB VAL 72 HB VAL 72 -0.959 3.289 -5.604 529 HG11 VAL 72 HG11 VAL 72 0.058 0.576 -6.415 530 HG12 VAL 72 HG12 VAL 72 -1.621 0.953 -6.155 531 HG13 VAL 72 HG13 VAL 72 -0.484 1.041 -4.823 532 HG21 VAL 72 HG21 VAL 72 1.449 3.842 -6.436 533 HG22 VAL 72 HG22 VAL 72 1.766 2.171 -6.062 534 HG23 VAL 72 HG23 VAL 72 1.195 3.261 -4.798 535 H ASP 73 HN ASP 73 -0.595 0.922 -9.207 536 HA ASP 73 HA ASP 73 -3.528 0.774 -8.934 537 HB2 ASP 73 HB2 ASP 73 -3.656 -0.431 -10.984 538 HB3 ASP 73 HB1 ASP 73 -2.679 0.990 -11.262 539 H PHE 74 HN PHE 74 -3.909 -1.923 -9.531 540 HA PHE 74 HA PHE 74 -3.955 -2.661 -6.871 541 HB2 PHE 74 HB2 PHE 74 -5.537 -3.536 -8.412 542 HB3 PHE 74 HB1 PHE 74 -4.291 -4.363 -9.322 543 HD1 PHE 74 HD1 PHE 74 -5.202 -6.515 -9.174 544 HD2 PHE 74 HD2 PHE 74 -4.438 -4.293 -5.625 545 HE1 PHE 74 HE1 PHE 74 -5.532 -8.546 -7.830 546 HE2 PHE 74 HE2 PHE 74 -4.761 -6.330 -4.275 547 HZ PHE 74 HZ PHE 74 -5.315 -8.456 -5.387 548 H ASP 75 HN ASP 75 -1.942 -4.322 -9.336 549 HA ASP 75 HA ASP 75 -0.693 -5.909 -7.388 550 HB2 ASP 75 HB2 ASP 75 0.739 -6.686 -9.124 551 HB3 ASP 75 HB1 ASP 75 -0.870 -6.532 -9.775 552 H GLU 76 HN GLU 76 0.044 -2.726 -8.592 553 HA GLU 76 HA GLU 76 2.613 -2.465 -7.529 554 HB2 GLU 76 HB2 GLU 76 0.590 -0.342 -7.691 555 HB3 GLU 76 HB1 GLU 76 2.283 -0.120 -7.709 556 HG2 GLU 76 HG2 GLU 76 2.232 -1.494 -9.869 557 HG3 GLU 76 HG1 GLU 76 0.501 -1.189 -9.804 558 H PHE 77 HN PHE 77 -0.453 -1.413 -6.224 559 HA PHE 77 HA PHE 77 0.202 -0.754 -3.619 560 HB2 PHE 77 HB2 PHE 77 -2.042 -0.426 -4.555 561 HB3 PHE 77 HB1 PHE 77 -2.275 -2.165 -4.638 562 HD1 PHE 77 HD1 PHE 77 -3.236 -3.311 -2.862 563 HD2 PHE 77 HD2 PHE 77 -1.691 0.601 -2.233 564 HE1 PHE 77 HE1 PHE 77 -4.164 -3.314 -0.587 565 HE2 PHE 77 HE2 PHE 77 -2.622 0.602 0.043 566 HZ PHE 77 HZ PHE 77 -3.856 -1.355 0.870 567 H LEU 78 HN LEU 78 -0.652 -3.857 -4.982 568 HA LEU 78 HA LEU 78 -0.838 -5.374 -2.685 569 HB2 LEU 78 HB2 LEU 78 -0.875 -5.739 -5.429 570 HB3 LEU 78 HB1 LEU 78 0.254 -6.918 -4.805 571 HG LEU 78 HG LEU 78 -2.617 -6.562 -3.948 572 HD11 LEU 78 HD11 LEU 78 -2.919 -8.738 -4.957 573 HD12 LEU 78 HD12 LEU 78 -1.234 -8.742 -5.459 574 HD13 LEU 78 HD13 LEU 78 -2.352 -7.568 -6.140 575 HD21 LEU 78 HD21 LEU 78 -1.932 -7.502 -2.063 576 HD22 LEU 78 HD22 LEU 78 -0.332 -7.848 -2.725 577 HD23 LEU 78 HD23 LEU 78 -1.663 -8.963 -3.020 578 H VAL 79 HN VAL 79 2.015 -4.685 -4.644 579 HA VAL 79 HA VAL 79 3.643 -6.547 -3.265 580 HB VAL 79 HB VAL 79 4.095 -4.471 -5.313 581 HG11 VAL 79 HG11 VAL 79 6.594 -4.664 -5.041 582 HG12 VAL 79 HG12 VAL 79 6.310 -5.389 -3.456 583 HG13 VAL 79 HG13 VAL 79 5.818 -3.724 -3.770 584 HG21 VAL 79 HG21 VAL 79 3.762 -6.938 -5.667 585 HG22 VAL 79 HG22 VAL 79 5.337 -7.185 -4.891 586 HG23 VAL 79 HG23 VAL 79 5.225 -6.275 -6.396 587 H MET 80 HN MET 80 3.142 -3.051 -2.816 588 HA MET 80 HA MET 80 5.006 -3.027 -0.658 589 HB2 MET 80 HB2 MET 80 4.409 -0.949 -1.849 590 HB3 MET 80 HB1 MET 80 2.766 -1.072 -1.229 591 HG2 MET 80 HG2 MET 80 4.092 0.519 0.057 592 HG3 MET 80 HG1 MET 80 3.583 -0.849 1.051 593 HE1 MET 80 HE1 MET 80 6.932 -0.354 2.789 594 HE2 MET 80 HE2 MET 80 5.202 -0.661 2.941 595 HE3 MET 80 HE3 MET 80 5.770 0.882 2.311 596 H MET 81 HN MET 81 1.639 -3.708 -1.073 597 HA MET 81 HA MET 81 0.735 -3.826 1.565 598 HB2 MET 81 HB2 MET 81 -0.673 -4.032 -0.405 599 HB3 MET 81 HB1 MET 81 0.037 -5.581 -0.732 600 HG2 MET 81 HG2 MET 81 -2.113 -5.852 0.233 601 HG3 MET 81 HG1 MET 81 -0.896 -6.429 1.347 602 HE1 MET 81 HE1 MET 81 -0.269 -5.389 3.487 603 HE2 MET 81 HE2 MET 81 -1.773 -6.302 3.619 604 HE3 MET 81 HE3 MET 81 -1.600 -4.764 4.466 605 H VAL 82 HN VAL 82 1.958 -6.464 -0.459 606 HA VAL 82 HA VAL 82 2.203 -8.303 1.632 607 HB VAL 82 HB VAL 82 2.208 -8.930 -0.774 608 HG11 VAL 82 HG11 VAL 82 5.075 -8.130 -0.578 609 HG12 VAL 82 HG12 VAL 82 3.837 -7.277 -1.489 610 HG13 VAL 82 HG13 VAL 82 4.311 -8.914 -1.963 611 HG21 VAL 82 HG21 VAL 82 2.911 -10.438 1.147 612 HG22 VAL 82 HG22 VAL 82 4.578 -10.075 0.684 613 HG23 VAL 82 HG23 VAL 82 3.492 -10.877 -0.463 614 H ARG 83 HN ARG 83 4.283 -5.838 0.464 615 HA ARG 83 HA ARG 83 6.712 -6.647 1.626 616 HB2 ARG 83 HB2 ARG 83 6.218 -4.927 -0.199 617 HB3 ARG 83 HB1 ARG 83 5.887 -3.828 1.114 618 HG2 ARG 83 HG2 ARG 83 8.151 -4.018 1.909 619 HG3 ARG 83 HG1 ARG 83 8.500 -5.217 0.662 620 HD2 ARG 83 HD2 ARG 83 7.989 -3.573 -1.070 621 HD3 ARG 83 HD1 ARG 83 7.637 -2.372 0.170 622 HE ARG 83 HE ARG 83 10.293 -3.550 0.217 623 HH11 ARG 83 HH11 ARG 83 8.253 -0.861 -0.718 624 HH12 ARG 83 HH12 ARG 83 9.588 0.236 -0.936 625 HH21 ARG 83 HH21 ARG 83 12.036 -2.115 -0.046 626 HH22 ARG 83 HH22 ARG 83 11.737 -0.485 -0.563 627 H SER 84 HN SER 84 4.192 -4.423 2.747 628 HA SER 84 HA SER 84 5.644 -3.691 5.100 629 HB2 SER 84 HB2 SER 84 3.439 -2.525 5.666 630 HB3 SER 84 HB1 SER 84 4.238 -2.011 4.176 631 HG SER 84 HG SER 84 2.746 -3.082 2.990 632 H MET 85 HN MET 85 3.185 -6.056 4.323 633 HA MET 85 HA MET 85 2.641 -6.586 7.118 634 HB2 MET 85 HB2 MET 85 0.958 -8.105 6.385 635 HB3 MET 85 HB1 MET 85 0.845 -6.661 5.383 636 HG2 MET 85 HG2 MET 85 1.594 -7.704 3.540 637 HG3 MET 85 HG1 MET 85 2.564 -8.862 4.430 638 HE1 MET 85 HE1 MET 85 0.904 -9.814 1.921 639 HE2 MET 85 HE2 MET 85 0.236 -11.310 2.570 640 HE3 MET 85 HE3 MET 85 1.895 -10.845 2.953 641 H LYS 86 HN LYS 86 5.045 -7.468 5.057 642 HA LYS 86 HA LYS 86 5.049 -10.292 5.587 643 HB2 LYS 86 HB2 LYS 86 6.246 -8.593 3.660 644 HB3 LYS 86 HB1 LYS 86 7.524 -9.472 4.486 645 HG2 LYS 86 HG2 LYS 86 5.101 -10.792 3.294 646 HG3 LYS 86 HG1 LYS 86 6.635 -10.601 2.442 647 HD2 LYS 86 HD2 LYS 86 7.770 -11.894 4.132 648 HD3 LYS 86 HD1 LYS 86 6.290 -12.003 5.078 649 HE2 LYS 86 HE2 LYS 86 6.619 -13.118 2.303 650 HE3 LYS 86 HE1 LYS 86 6.832 -14.057 3.778 651 HZ1 LYS 86 HZ1 LYS 86 4.515 -13.458 4.367 652 HZ2 LYS 86 HZ2 LYS 86 4.636 -14.406 2.972 653 HZ3 LYS 86 HZ3 LYS 86 4.343 -12.749 2.840 654 H ASP 87 HN ASP 87 5.293 -8.447 7.859 655 HA ASP 87 HA ASP 87 7.937 -8.802 8.888 656 HB2 ASP 87 HB2 ASP 87 6.976 -8.042 11.039 657 HB3 ASP 87 HB1 ASP 87 6.574 -6.959 9.713 658 H ASP 88 HN ASP 88 8.467 -10.924 8.745 659 HA ASP 88 HA ASP 88 6.825 -13.065 9.619 660 HB2 ASP 88 HB2 ASP 88 9.836 -13.067 9.334 661 HB3 ASP 88 HB1 ASP 88 8.774 -14.469 9.319 662 H SER 89 HN SER 89 8.644 -10.788 11.294 663 HA SER 89 HA SER 89 9.462 -12.290 13.542 664 HB2 SER 89 HB2 SER 89 8.810 -9.342 13.449 665 HB3 SER 89 HB1 SER 89 9.907 -10.165 14.560 666 HG SER 89 HG SER 89 11.342 -10.481 12.929 667 H LYS 90 HN LYS 90 7.893 -13.492 14.503 668 HA LYS 90 HA LYS 90 5.301 -12.383 15.103 669 HB2 LYS 90 HB2 LYS 90 6.549 -14.978 15.996 670 HB3 LYS 90 HB1 LYS 90 4.857 -14.540 16.168 671 HG2 LYS 90 HG2 LYS 90 4.665 -14.428 13.714 672 HG3 LYS 90 HG1 LYS 90 6.347 -14.938 13.583 673 HD2 LYS 90 HD2 LYS 90 4.918 -16.843 13.254 674 HD3 LYS 90 HD1 LYS 90 5.765 -17.017 14.792 675 HE2 LYS 90 HE2 LYS 90 3.808 -16.316 16.005 676 HE3 LYS 90 HE1 LYS 90 2.958 -15.952 14.504 677 HZ1 LYS 90 HZ1 LYS 90 2.237 -18.061 15.359 678 HZ2 LYS 90 HZ2 LYS 90 3.827 -18.632 15.434 679 HZ3 LYS 90 HZ3 LYS 90 3.112 -18.321 13.933 680 H GLY 136 HN GLY 136 6.375 -10.558 16.215 681 HA2 GLY 136 HA2 GLY 136 6.071 -10.616 18.971 682 HA3 GLY 136 HA1 GLY 136 7.777 -10.902 18.654 683 H LYS 137 HN LYS 137 7.783 -9.290 16.233 684 HA LYS 137 HA LYS 137 6.972 -6.639 17.061 685 HB2 LYS 137 HB2 LYS 137 9.141 -5.605 16.712 686 HB3 LYS 137 HB1 LYS 137 9.218 -6.767 18.033 687 HG2 LYS 137 HG2 LYS 137 10.123 -7.383 15.228 688 HG3 LYS 137 HG1 LYS 137 11.188 -6.720 16.464 689 HD2 LYS 137 HD2 LYS 137 10.618 -8.701 17.890 690 HD3 LYS 137 HD1 LYS 137 9.762 -9.377 16.501 691 HE2 LYS 137 HE2 LYS 137 11.810 -9.372 15.201 692 HE3 LYS 137 HE1 LYS 137 12.677 -8.604 16.528 693 HZ1 LYS 137 HZ1 LYS 137 12.247 -10.567 17.881 694 HZ2 LYS 137 HZ2 LYS 137 13.102 -10.963 16.480 695 HZ3 LYS 137 HZ3 LYS 137 11.455 -11.305 16.585 696 H PHE 138 HN PHE 138 7.809 -5.048 15.320 697 HA PHE 138 HA PHE 138 6.975 -6.106 12.746 698 HB2 PHE 138 HB2 PHE 138 5.981 -4.034 13.642 699 HB3 PHE 138 HB1 PHE 138 7.572 -3.293 13.692 700 HD1 PHE 138 HD1 PHE 138 8.089 -1.856 12.031 701 HD2 PHE 138 HD2 PHE 138 5.392 -5.036 11.221 702 HE1 PHE 138 HE1 PHE 138 7.779 -0.998 9.739 703 HE2 PHE 138 HE2 PHE 138 5.074 -4.195 8.925 704 HZ PHE 138 HZ PHE 138 6.270 -2.172 8.184 705 H LYS 139 HN LYS 139 8.360 -6.370 11.043 706 HA LYS 139 HA LYS 139 11.166 -6.267 11.486 707 HB2 LYS 139 HB2 LYS 139 9.473 -6.818 9.068 708 HB3 LYS 139 HB1 LYS 139 11.213 -6.630 8.911 709 HG2 LYS 139 HG2 LYS 139 11.463 -8.439 10.636 710 HG3 LYS 139 HG1 LYS 139 9.725 -8.711 10.491 711 HD2 LYS 139 HD2 LYS 139 9.929 -9.337 8.206 712 HD3 LYS 139 HD1 LYS 139 11.601 -8.780 8.135 713 HE2 LYS 139 HE2 LYS 139 12.215 -10.536 9.762 714 HE3 LYS 139 HE1 LYS 139 10.553 -11.119 9.726 715 HZ1 LYS 139 HZ1 LYS 139 12.132 -12.348 8.259 716 HZ2 LYS 139 HZ2 LYS 139 12.275 -10.957 7.317 717 HZ3 LYS 139 HZ3 LYS 139 10.775 -11.732 7.455 718 H ARG 140 HN ARG 140 12.378 -5.192 9.299 719 HA ARG 140 HA ARG 140 12.343 -2.443 9.885 720 HB2 ARG 140 HB2 ARG 140 13.658 -2.226 7.706 721 HB3 ARG 140 HB1 ARG 140 14.359 -3.148 9.015 722 HG2 ARG 140 HG2 ARG 140 14.804 -4.391 7.070 723 HG3 ARG 140 HG1 ARG 140 13.459 -5.225 7.843 724 HD2 ARG 140 HD2 ARG 140 11.912 -4.008 6.334 725 HD3 ARG 140 HD1 ARG 140 13.311 -3.321 5.511 726 HE ARG 140 HE ARG 140 13.923 -5.705 4.996 727 HH11 ARG 140 HH11 ARG 140 10.593 -4.810 5.625 728 HH12 ARG 140 HH12 ARG 140 9.933 -6.022 4.573 729 HH21 ARG 140 HH21 ARG 140 13.044 -7.310 3.595 730 HH22 ARG 140 HH22 ARG 140 11.318 -7.434 3.416 731 HA PRO 141 HA PRO 141 9.131 -0.934 7.305 732 HB2 PRO 141 HB2 PRO 141 10.039 1.719 7.799 733 HB3 PRO 141 HB1 PRO 141 8.746 0.871 8.644 734 HG2 PRO 141 HG2 PRO 141 11.206 1.616 9.742 735 HG3 PRO 141 HG1 PRO 141 10.044 0.499 10.447 736 HD2 PRO 141 HD2 PRO 141 12.553 -0.029 8.962 737 HD3 PRO 141 HD1 PRO 141 11.761 -0.940 10.232 738 H THR 142 HN THR 142 9.298 -0.737 5.115 739 HA THR 142 HA THR 142 11.968 -0.367 4.101 740 HB THR 142 HB THR 142 10.752 -0.767 1.851 741 HG1 THR 142 HG1 THR 142 8.679 -1.242 1.952 742 HG21 THR 142 HG21 THR 142 12.155 -2.435 2.992 743 HG22 THR 142 HG22 THR 142 10.757 -3.183 2.221 744 HG23 THR 142 HG23 THR 142 10.770 -2.924 3.963 745 H LEU 143 HN LEU 143 9.520 1.615 4.888 746 HA LEU 143 HA LEU 143 10.515 3.766 3.233 747 HB2 LEU 143 HB2 LEU 143 7.699 2.765 3.182 748 HB3 LEU 143 HB1 LEU 143 8.119 4.398 2.698 749 HG LEU 143 HG LEU 143 9.386 1.983 1.438 750 HD11 LEU 143 HD11 LEU 143 6.876 3.441 0.646 751 HD12 LEU 143 HD12 LEU 143 7.031 1.736 1.076 752 HD13 LEU 143 HD13 LEU 143 7.764 2.343 -0.406 753 HD21 LEU 143 HD21 LEU 143 9.740 3.572 -0.409 754 HD22 LEU 143 HD22 LEU 143 10.550 4.053 1.085 755 HD23 LEU 143 HD23 LEU 143 9.050 4.850 0.593 756 H ARG 144 HN ARG 144 11.126 5.053 4.919 757 HA ARG 144 HA ARG 144 9.485 5.260 7.283 758 HB2 ARG 144 HB2 ARG 144 11.959 6.761 6.411 759 HB3 ARG 144 HB1 ARG 144 11.125 7.067 7.927 760 HG2 ARG 144 HG2 ARG 144 12.926 5.664 8.459 761 HG3 ARG 144 HG1 ARG 144 11.501 4.627 8.475 762 HD2 ARG 144 HD2 ARG 144 12.049 3.853 6.214 763 HD3 ARG 144 HD1 ARG 144 13.483 4.878 6.215 764 HE ARG 144 HE ARG 144 13.623 3.226 8.456 765 HH11 ARG 144 HH11 ARG 144 13.679 2.932 4.966 766 HH12 ARG 144 HH12 ARG 144 14.630 1.483 4.975 767 HH21 ARG 144 HH21 ARG 144 14.897 1.336 8.473 768 HH22 ARG 144 HH22 ARG 144 15.336 0.580 6.973 769 H ARG 145 HN ARG 145 7.599 5.831 6.114 770 HA ARG 145 HA ARG 145 7.556 8.620 5.212 771 HB2 ARG 145 HB2 ARG 145 5.951 6.256 4.304 772 HB3 ARG 145 HB1 ARG 145 5.595 7.918 3.837 773 HG2 ARG 145 HG2 ARG 145 8.314 6.789 3.474 774 HG3 ARG 145 HG1 ARG 145 7.053 6.467 2.280 775 HD2 ARG 145 HD2 ARG 145 8.102 8.343 1.436 776 HD3 ARG 145 HD1 ARG 145 6.742 9.024 2.319 777 HE ARG 145 HE ARG 145 8.869 8.962 4.089 778 HH11 ARG 145 HH11 ARG 145 8.129 10.479 1.019 779 HH12 ARG 145 HH12 ARG 145 9.109 11.875 1.326 780 HH21 ARG 145 HH21 ARG 145 10.154 10.828 4.492 781 HH22 ARG 145 HH22 ARG 145 10.250 12.074 3.289 782 H VAL 146 HN VAL 146 5.507 6.077 6.660 783 HA VAL 146 HA VAL 146 4.189 8.088 8.307 784 HB VAL 146 HB VAL 146 2.602 6.230 6.523 785 HG11 VAL 146 HG11 VAL 146 1.483 6.734 8.618 786 HG12 VAL 146 HG12 VAL 146 0.670 7.549 7.288 787 HG13 VAL 146 HG13 VAL 146 1.729 8.458 8.360 788 HG21 VAL 146 HG21 VAL 146 1.930 8.333 5.349 789 HG22 VAL 146 HG22 VAL 146 3.624 7.907 5.141 790 HG23 VAL 146 HG23 VAL 146 3.172 9.182 6.269 791 H ARG 147 HN ARG 147 2.670 7.077 9.874 792 HA ARG 147 HA ARG 147 4.039 4.841 11.096 793 HB2 ARG 147 HB2 ARG 147 1.861 6.436 12.395 794 HB3 ARG 147 HB1 ARG 147 3.130 5.505 13.165 795 HG2 ARG 147 HG2 ARG 147 3.602 7.814 13.497 796 HG3 ARG 147 HG1 ARG 147 4.772 7.197 12.325 797 HD2 ARG 147 HD2 ARG 147 3.833 8.326 10.577 798 HD3 ARG 147 HD1 ARG 147 2.243 8.317 11.306 799 HE ARG 147 HE ARG 147 3.125 10.099 12.829 800 HH11 ARG 147 HH11 ARG 147 4.700 9.540 9.748 801 HH12 ARG 147 HH12 ARG 147 5.129 11.201 9.519 802 HH21 ARG 147 HH21 ARG 147 3.713 12.289 12.536 803 HH22 ARG 147 HH22 ARG 147 4.590 12.762 11.115 804 H ILE 148 HN ILE 148 3.052 3.310 9.563 805 HA ILE 148 HA ILE 148 0.301 2.602 10.338 806 HB ILE 148 HB ILE 148 1.416 2.935 7.591 807 HG12 ILE 148 HG12 ILE 148 -1.360 3.616 8.533 808 HG13 ILE 148 HG11 ILE 148 0.000 4.659 8.906 809 HG21 ILE 148 HG21 ILE 148 -0.933 1.181 8.311 810 HG22 ILE 148 HG22 ILE 148 0.619 0.634 7.667 811 HG23 ILE 148 HG23 ILE 148 -0.442 1.635 6.668 812 HD11 ILE 148 HD11 ILE 148 -1.079 5.472 6.950 813 HD12 ILE 148 HD12 ILE 148 -1.006 3.876 6.196 814 HD13 ILE 148 HD13 ILE 148 0.479 4.791 6.482 815 H SER 149 HN SER 149 0.088 0.505 10.896 816 HA SER 149 HA SER 149 2.031 -1.455 9.972 817 HB2 SER 149 HB2 SER 149 -0.512 -1.937 11.531 818 HB3 SER 149 HB1 SER 149 0.870 -3.017 11.362 819 HG SER 149 HG SER 149 0.694 -1.721 13.372 820 H ALA 150 HN ALA 150 1.572 -2.982 8.391 821 HA ALA 150 HA ALA 150 0.166 -2.190 6.189 822 HB1 ALA 150 HB1 ALA 150 0.391 -4.440 5.359 823 HB2 ALA 150 HB2 ALA 150 0.653 -5.051 6.994 824 HB3 ALA 150 HB3 ALA 150 1.845 -3.986 6.245 825 H ASP 151 HN ASP 151 -0.929 -4.764 8.362 826 HA ASP 151 HA ASP 151 -3.472 -5.123 7.276 827 HB2 ASP 151 HB2 ASP 151 -2.317 -6.634 8.864 828 HB3 ASP 151 HB1 ASP 151 -2.646 -5.460 10.141 829 H ALA 152 HN ALA 152 -2.287 -2.963 9.748 830 HA ALA 152 HA ALA 152 -4.755 -2.213 10.827 831 HB1 ALA 152 HB1 ALA 152 -3.567 -0.459 11.920 832 HB2 ALA 152 HB2 ALA 152 -2.225 -0.599 10.781 833 HB3 ALA 152 HB3 ALA 152 -2.573 -1.914 11.911 834 H MET 153 HN MET 153 -2.797 -0.801 8.250 835 HA MET 153 HA MET 153 -4.315 1.517 7.784 836 HB2 MET 153 HB2 MET 153 -2.139 1.162 6.813 837 HB3 MET 153 HB1 MET 153 -2.735 -0.188 5.871 838 HG2 MET 153 HG2 MET 153 -4.233 1.358 4.671 839 HG3 MET 153 HG1 MET 153 -3.521 2.699 5.573 840 HE1 MET 153 HE1 MET 153 -1.271 0.009 2.613 841 HE2 MET 153 HE2 MET 153 -2.958 -0.184 3.099 842 HE3 MET 153 HE3 MET 153 -1.658 -0.504 4.257 843 H MET 154 HN MET 154 -4.350 -1.591 6.047 844 HA MET 154 HA MET 154 -6.588 -1.039 4.447 845 HB2 MET 154 HB2 MET 154 -6.668 -3.488 4.073 846 HB3 MET 154 HB1 MET 154 -5.069 -2.813 3.853 847 HG2 MET 154 HG2 MET 154 -4.439 -3.599 6.086 848 HG3 MET 154 HG1 MET 154 -6.028 -4.333 6.262 849 HE1 MET 154 HE1 MET 154 -6.893 -5.812 3.993 850 HE2 MET 154 HE2 MET 154 -5.804 -6.891 3.154 851 HE3 MET 154 HE3 MET 154 -5.854 -5.182 2.723 852 H GLN 155 HN GLN 155 -6.283 -2.439 7.676 853 HA GLN 155 HA GLN 155 -8.754 -3.620 7.990 854 HB2 GLN 155 HB2 GLN 155 -6.740 -3.495 9.633 855 HB3 GLN 155 HB1 GLN 155 -7.567 -2.074 10.261 856 HG2 GLN 155 HG2 GLN 155 -9.607 -3.522 10.489 857 HG3 GLN 155 HG1 GLN 155 -8.560 -4.899 10.186 858 HE21 GLN 155 HE21 GLN 155 -7.101 -5.545 11.738 859 HE22 GLN 155 HE22 GLN 155 -7.127 -4.946 13.360 860 H ALA 156 HN ALA 156 -7.928 -0.220 8.131 861 HA ALA 156 HA ALA 156 -10.218 0.764 9.393 862 HB1 ALA 156 HB1 ALA 156 -9.686 2.905 8.417 863 HB2 ALA 156 HB2 ALA 156 -8.632 2.132 7.237 864 HB3 ALA 156 HB3 ALA 156 -8.202 2.107 8.944 865 H LEU 157 HN LEU 157 -9.563 0.273 5.942 866 HA LEU 157 HA LEU 157 -12.283 0.957 5.220 867 HB2 LEU 157 HB2 LEU 157 -11.379 0.082 2.910 868 HB3 LEU 157 HB1 LEU 157 -10.993 1.677 3.483 869 HG LEU 157 HG LEU 157 -9.099 -0.543 4.119 870 HD11 LEU 157 HD11 LEU 157 -7.975 -0.336 2.033 871 HD12 LEU 157 HD12 LEU 157 -9.115 0.890 1.475 872 HD13 LEU 157 HD13 LEU 157 -9.658 -0.770 1.701 873 HD21 LEU 157 HD21 LEU 157 -9.028 2.397 3.671 874 HD22 LEU 157 HD22 LEU 157 -7.567 1.444 3.450 875 HD23 LEU 157 HD23 LEU 157 -8.379 1.456 5.021 876 H LEU 158 HN LEU 158 -10.511 -1.833 5.995 877 HA LEU 158 HA LEU 158 -11.764 -3.702 4.320 878 HB2 LEU 158 HB2 LEU 158 -10.210 -3.906 6.823 879 HB3 LEU 158 HB1 LEU 158 -10.936 -5.316 6.139 880 HG LEU 158 HG LEU 158 -8.800 -3.617 5.013 881 HD11 LEU 158 HD11 LEU 158 -7.460 -5.290 5.549 882 HD12 LEU 158 HD12 LEU 158 -8.560 -6.476 4.830 883 HD13 LEU 158 HD13 LEU 158 -8.803 -5.935 6.496 884 HD21 LEU 158 HD21 LEU 158 -8.937 -5.123 3.014 885 HD22 LEU 158 HD22 LEU 158 -10.199 -3.904 3.159 886 HD23 LEU 158 HD23 LEU 158 -10.536 -5.575 3.596 887 H GLY 159 HN GLY 159 -13.174 -2.022 6.813 888 HA2 GLY 159 HA2 GLY 159 -14.583 -3.994 8.219 889 HA3 GLY 159 HA1 GLY 159 -15.106 -2.335 8.014 890 H ALA 160 HN ALA 160 -14.857 -3.194 4.962 891 HA ALA 160 HA ALA 160 -17.601 -3.739 4.518 892 HB1 ALA 160 HB1 ALA 160 -15.238 -4.069 2.671 893 HB2 ALA 160 HB2 ALA 160 -16.230 -2.619 2.847 894 HB3 ALA 160 HB3 ALA 160 -16.933 -4.096 2.184 895 H ARG 161 HN ARG 161 -14.863 -5.741 5.169 896 HA ARG 161 HA ARG 161 -16.474 -8.148 4.742 897 HB2 ARG 161 HB2 ARG 161 -14.366 -9.208 3.720 898 HB3 ARG 161 HB1 ARG 161 -15.314 -8.137 2.704 899 HG2 ARG 161 HG2 ARG 161 -13.742 -6.325 3.117 900 HG3 ARG 161 HG1 ARG 161 -12.795 -7.383 4.168 901 HD2 ARG 161 HD2 ARG 161 -11.810 -7.250 1.939 902 HD3 ARG 161 HD1 ARG 161 -12.373 -8.881 2.295 903 HE ARG 161 HE ARG 161 -14.209 -7.171 0.825 904 HH11 ARG 161 HH11 ARG 161 -11.795 -9.697 0.728 905 HH12 ARG 161 HH12 ARG 161 -12.274 -10.272 -0.840 906 HH21 ARG 161 HH21 ARG 161 -14.867 -7.947 -1.232 907 HH22 ARG 161 HH22 ARG 161 -14.035 -9.300 -1.933 908 H ALA 162 HN ALA 162 -13.625 -6.654 6.159 909 HA ALA 162 HA ALA 162 -12.752 -8.921 7.646 910 HB1 ALA 162 HB1 ALA 162 -12.189 -5.978 8.021 911 HB2 ALA 162 HB2 ALA 162 -11.220 -7.127 7.085 912 HB3 ALA 162 HB3 ALA 162 -11.338 -7.292 8.837 913 H LYS 163 HN LYS 163 -13.945 -5.831 8.881 914 HA LYS 163 HA LYS 163 -15.280 -7.286 11.053 915 HB2 LYS 163 HB2 LYS 163 -14.770 -5.144 12.398 916 HB3 LYS 163 HB1 LYS 163 -13.468 -6.290 12.132 917 HG2 LYS 163 HG2 LYS 163 -12.272 -4.842 10.916 918 HG3 LYS 163 HG1 LYS 163 -13.693 -4.226 10.073 919 HD2 LYS 163 HD2 LYS 163 -13.018 -3.528 12.923 920 HD3 LYS 163 HD1 LYS 163 -12.508 -2.562 11.536 921 HE2 LYS 163 HE2 LYS 163 -14.869 -2.295 10.885 922 HE3 LYS 163 HE1 LYS 163 -15.356 -3.210 12.309 923 HZ1 LYS 163 HZ1 LYS 163 -15.514 -0.821 12.677 924 HZ2 LYS 163 HZ2 LYS 163 -13.870 -0.636 12.346 925 HZ3 LYS 163 HZ3 LYS 163 -14.365 -1.511 13.705 926 H GLY 164 HN GLY 164 -17.384 -7.115 10.753 927 HA2 GLY 164 HA2 GLY 164 -19.229 -5.486 11.068 928 HA3 GLY 164 HA1 GLY 164 -18.421 -4.505 9.852 929 H HIS 165 HN HIS 165 -20.843 -6.733 10.367 930 HA HIS 165 HA HIS 165 -20.712 -7.789 7.628 931 HB2 HIS 165 HB2 HIS 165 -22.345 -8.677 10.011 932 HB3 HIS 165 HB1 HIS 165 -22.519 -9.356 8.399 933 HD1 HIS 165 HD1 HIS 165 -20.856 -11.138 7.700 934 HD2 HIS 165 HD2 HIS 165 -19.865 -9.300 11.296 935 HE1 HIS 165 HE1 HIS 165 -18.972 -12.496 8.660 936 HE2 HIS 165 HE2 HIS 165 -18.275 -11.263 10.742 937 HAB 9XG 201 HAB DRG 201 4.432 3.563 6.702 938 HAC 9XG 201 HAC DRG 201 3.029 2.477 6.525 939 HAA 9XG 201 HAA DRG 201 2.833 4.236 6.298 940 HAD 9XG 201 HAD DRG 201 -0.026 2.679 -2.593 941 HAE 9XG 201 HAE DRG 201 -1.275 1.780 -0.647 942 HAF 9XG 201 HAF DRG 201 2.407 3.126 -2.402 943 HAG 9XG 201 HAG DRG 201 6.113 4.159 2.503 944 HAH 9XG 201 HAH DRG 201 5.600 4.404 4.919 945 HAI 9XG 201 HAI DRG 201 -0.080 1.261 1.462 946 HAJ 9XG 201 HAJ DRG 201 3.596 2.632 -0.292 947 HAK 9XG 201 HAK DRG 201 4.618 2.827 1.047 948 HAL 9XG 201 HAL DRG 201 2.041 2.057 4.395 949 HAM 9XG 201 HAM DRG 201 2.321 0.670 2.174 Start of MODEL 8 1 H1 MET 1 HT1 MET 1 10.360 -0.349 -7.370 2 H2 MET 1 HT2 MET 1 11.546 -1.520 -7.656 3 H3 MET 1 HT3 MET 1 11.373 -0.851 -6.114 4 HA MET 1 HA MET 1 9.233 -1.852 -5.842 5 HB2 MET 1 HB2 MET 1 8.819 -1.743 -8.395 6 HB3 MET 1 HB1 MET 1 9.689 -3.270 -8.461 7 HG2 MET 1 HG2 MET 1 7.335 -3.726 -8.407 8 HG3 MET 1 HG1 MET 1 8.057 -4.221 -6.879 9 HE1 MET 1 HE1 MET 1 4.340 -2.818 -6.363 10 HE2 MET 1 HE2 MET 1 5.295 -4.275 -6.683 11 HE3 MET 1 HE3 MET 1 4.918 -3.157 -8.000 12 H ASP 2 HN ASP 2 9.721 -3.324 -4.307 13 HA ASP 2 HA ASP 2 11.992 -5.013 -4.460 14 HB2 ASP 2 HB2 ASP 2 9.719 -4.719 -2.626 15 HB3 ASP 2 HB1 ASP 2 10.463 -6.304 -2.660 16 H ASP 3 HN ASP 3 12.108 -6.441 -6.118 17 HA ASP 3 HA ASP 3 9.815 -7.721 -7.185 18 HB2 ASP 3 HB2 ASP 3 11.437 -9.147 -8.415 19 HB3 ASP 3 HB1 ASP 3 11.714 -7.425 -8.603 20 H ILE 4 HN ILE 4 11.811 -8.374 -4.460 21 HA ILE 4 HA ILE 4 11.291 -11.114 -4.191 22 HB ILE 4 HB ILE 4 12.917 -9.873 -2.769 23 HG12 ILE 4 HG12 ILE 4 11.840 -12.113 -2.081 24 HG13 ILE 4 HG11 ILE 4 12.694 -11.200 -0.845 25 HG21 ILE 4 HG21 ILE 4 10.463 -8.757 -1.457 26 HG22 ILE 4 HG22 ILE 4 11.703 -7.871 -2.340 27 HG23 ILE 4 HG23 ILE 4 12.094 -8.633 -0.798 28 HD11 ILE 4 HD11 ILE 4 10.580 -10.394 0.033 29 HD12 ILE 4 HD12 ILE 4 10.607 -12.158 -0.008 30 HD13 ILE 4 HD13 ILE 4 9.712 -11.255 -1.232 31 H TYR 5 HN TYR 5 9.527 -8.258 -3.194 32 HA TYR 5 HA TYR 5 7.278 -9.733 -2.209 33 HB2 TYR 5 HB2 TYR 5 7.803 -6.804 -2.599 34 HB3 TYR 5 HB1 TYR 5 6.299 -7.462 -1.972 35 HD1 TYR 5 HD1 TYR 5 9.460 -6.211 -0.964 36 HD2 TYR 5 HD2 TYR 5 6.610 -9.221 -0.018 37 HE1 TYR 5 HE1 TYR 5 10.362 -6.382 1.312 38 HE2 TYR 5 HE2 TYR 5 7.476 -9.363 2.224 39 HH TYR 5 HH TYR 5 9.465 -8.946 3.444 40 H LYS 6 HN LYS 6 8.269 -8.106 -5.090 41 HA LYS 6 HA LYS 6 5.840 -8.095 -6.437 42 HB2 LYS 6 HB2 LYS 6 8.120 -7.136 -7.101 43 HB3 LYS 6 HB1 LYS 6 8.378 -8.704 -7.867 44 HG2 LYS 6 HG2 LYS 6 6.419 -8.392 -9.233 45 HG3 LYS 6 HG1 LYS 6 6.029 -6.915 -8.362 46 HD2 LYS 6 HD2 LYS 6 7.974 -5.833 -9.165 47 HD3 LYS 6 HD1 LYS 6 8.539 -7.318 -9.934 48 HE2 LYS 6 HE2 LYS 6 6.733 -7.281 -11.497 49 HE3 LYS 6 HE1 LYS 6 5.939 -5.974 -10.627 50 HZ1 LYS 6 HZ1 LYS 6 7.541 -4.439 -11.339 51 HZ2 LYS 6 HZ2 LYS 6 7.167 -5.351 -12.710 52 HZ3 LYS 6 HZ3 LYS 6 8.605 -5.648 -11.872 53 H ALA 7 HN ALA 7 8.248 -10.606 -5.902 54 HA ALA 7 HA ALA 7 6.718 -12.734 -7.083 55 HB1 ALA 7 HB1 ALA 7 9.007 -12.730 -5.132 56 HB2 ALA 7 HB2 ALA 7 9.076 -13.038 -6.872 57 HB3 ALA 7 HB3 ALA 7 8.267 -14.185 -5.798 58 H ALA 8 HN ALA 8 6.759 -11.195 -3.953 59 HA ALA 8 HA ALA 8 5.798 -13.464 -2.534 60 HB1 ALA 8 HB1 ALA 8 5.572 -12.022 -0.669 61 HB2 ALA 8 HB2 ALA 8 5.693 -10.595 -1.692 62 HB3 ALA 8 HB3 ALA 8 7.090 -11.658 -1.495 63 H VAL 9 HN VAL 9 4.234 -10.654 -4.076 64 HA VAL 9 HA VAL 9 1.601 -11.350 -3.354 65 HB VAL 9 HB VAL 9 1.731 -9.273 -4.454 66 HG11 VAL 9 HG11 VAL 9 2.763 -9.012 -6.734 67 HG12 VAL 9 HG12 VAL 9 3.344 -10.679 -6.586 68 HG13 VAL 9 HG13 VAL 9 3.902 -9.437 -5.461 69 HG21 VAL 9 HG21 VAL 9 0.391 -9.445 -6.472 70 HG22 VAL 9 HG22 VAL 9 -0.176 -10.611 -5.277 71 HG23 VAL 9 HG23 VAL 9 0.815 -11.148 -6.633 72 H GLU 10 HN GLU 10 3.758 -12.483 -5.868 73 HA GLU 10 HA GLU 10 1.991 -14.224 -7.152 74 HB2 GLU 10 HB2 GLU 10 4.931 -14.703 -6.900 75 HB3 GLU 10 HB1 GLU 10 3.885 -15.043 -8.279 76 HG2 GLU 10 HG2 GLU 10 3.601 -12.566 -8.475 77 HG3 GLU 10 HG1 GLU 10 4.838 -12.415 -7.274 78 H GLN 11 HN GLN 11 3.944 -14.325 -4.382 79 HA GLN 11 HA GLN 11 3.715 -17.126 -3.822 80 HB2 GLN 11 HB2 GLN 11 5.759 -15.965 -3.319 81 HB3 GLN 11 HB1 GLN 11 4.887 -14.791 -2.398 82 HG2 GLN 11 HG2 GLN 11 4.204 -16.636 -0.920 83 HG3 GLN 11 HG1 GLN 11 5.415 -17.597 -1.724 84 HE21 GLN 11 HE21 GLN 11 7.230 -15.364 -2.090 85 HE22 GLN 11 HE22 GLN 11 7.924 -15.039 -0.539 86 H LEU 12 HN LEU 12 1.745 -14.396 -3.309 87 HA LEU 12 HA LEU 12 0.636 -15.206 -0.807 88 HB2 LEU 12 HB2 LEU 12 -0.375 -13.269 -2.867 89 HB3 LEU 12 HB1 LEU 12 -1.114 -13.529 -1.342 90 HG LEU 12 HG LEU 12 1.660 -12.417 -1.661 91 HD11 LEU 12 HD11 LEU 12 0.131 -10.791 -2.560 92 HD12 LEU 12 HD12 LEU 12 0.525 -10.270 -0.924 93 HD13 LEU 12 HD13 LEU 12 -1.013 -11.062 -1.258 94 HD21 LEU 12 HD21 LEU 12 -0.154 -12.856 0.704 95 HD22 LEU 12 HD22 LEU 12 1.197 -11.712 0.734 96 HD23 LEU 12 HD23 LEU 12 1.501 -13.426 0.465 97 H THR 13 HN THR 13 -1.531 -15.979 -0.536 98 HA THR 13 HA THR 13 -2.508 -17.724 -2.611 99 HB THR 13 HB THR 13 -4.195 -18.381 -1.024 100 HG1 THR 13 HG1 THR 13 -4.028 -17.116 1.116 101 HG21 THR 13 HG21 THR 13 -2.858 -18.988 0.943 102 HG22 THR 13 HG22 THR 13 -1.602 -17.861 0.429 103 HG23 THR 13 HG23 THR 13 -1.974 -19.276 -0.556 104 H GLU 14 HN GLU 14 -4.681 -17.507 -3.469 105 HA GLU 14 HA GLU 14 -5.429 -15.056 -4.442 106 HB2 GLU 14 HB2 GLU 14 -6.528 -16.712 -5.510 107 HB3 GLU 14 HB1 GLU 14 -6.706 -17.683 -4.055 108 HG2 GLU 14 HG2 GLU 14 -8.558 -16.475 -3.376 109 HG3 GLU 14 HG1 GLU 14 -8.251 -15.206 -4.525 110 H GLU 15 HN GLU 15 -6.663 -16.688 -1.604 111 HA GLU 15 HA GLU 15 -8.323 -14.904 -0.420 112 HB2 GLU 15 HB2 GLU 15 -6.083 -16.374 0.991 113 HB3 GLU 15 HB1 GLU 15 -7.619 -15.860 1.691 114 HG2 GLU 15 HG2 GLU 15 -8.821 -17.405 0.266 115 HG3 GLU 15 HG1 GLU 15 -7.307 -17.899 -0.495 116 H GLN 16 HN GLN 16 -4.848 -15.027 -0.003 117 HA GLN 16 HA GLN 16 -4.390 -12.889 1.560 118 HB2 GLN 16 HB2 GLN 16 -2.844 -14.010 -0.749 119 HB3 GLN 16 HB1 GLN 16 -2.221 -12.741 0.301 120 HG2 GLN 16 HG2 GLN 16 -3.325 -15.274 1.422 121 HG3 GLN 16 HG1 GLN 16 -1.684 -15.133 0.898 122 HE21 GLN 16 HE21 GLN 16 -3.978 -14.263 3.270 123 HE22 GLN 16 HE22 GLN 16 -2.907 -13.426 4.336 124 H LYS 17 HN LYS 17 -4.519 -12.954 -1.952 125 HA LYS 17 HA LYS 17 -4.094 -10.151 -2.122 126 HB2 LYS 17 HB2 LYS 17 -4.612 -12.273 -4.202 127 HB3 LYS 17 HB1 LYS 17 -4.201 -10.601 -4.580 128 HG2 LYS 17 HG2 LYS 17 -2.092 -10.855 -3.375 129 HG3 LYS 17 HG1 LYS 17 -2.531 -12.502 -2.961 130 HD2 LYS 17 HD2 LYS 17 -2.199 -11.511 -5.796 131 HD3 LYS 17 HD1 LYS 17 -0.935 -12.325 -4.868 132 HE2 LYS 17 HE2 LYS 17 -2.816 -14.125 -4.526 133 HE3 LYS 17 HE1 LYS 17 -3.449 -13.402 -6.004 134 HZ1 LYS 17 HZ1 LYS 17 -1.538 -13.957 -7.195 135 HZ2 LYS 17 HZ2 LYS 17 -1.840 -15.333 -6.260 136 HZ3 LYS 17 HZ3 LYS 17 -0.630 -14.246 -5.799 137 H ASN 18 HN ASN 18 -6.913 -12.196 -2.144 138 HA ASN 18 HA ASN 18 -8.717 -10.562 -3.527 139 HB2 ASN 18 HB2 ASN 18 -9.215 -12.863 -2.914 140 HB3 ASN 18 HB1 ASN 18 -9.260 -12.423 -1.213 141 HD21 ASN 18 HD21 ASN 18 -10.863 -12.146 -4.288 142 HD22 ASN 18 HD22 ASN 18 -12.409 -11.655 -3.683 143 H GLU 19 HN GLU 19 -7.897 -10.688 -0.096 144 HA GLU 19 HA GLU 19 -9.640 -8.588 0.673 145 HB2 GLU 19 HB2 GLU 19 -7.558 -10.214 1.928 146 HB3 GLU 19 HB1 GLU 19 -7.692 -8.591 2.590 147 HG2 GLU 19 HG2 GLU 19 -9.833 -8.956 3.356 148 HG3 GLU 19 HG1 GLU 19 -10.105 -10.291 2.260 149 H PHE 20 HN PHE 20 -6.187 -8.751 -0.064 150 HA PHE 20 HA PHE 20 -5.565 -6.076 0.463 151 HB2 PHE 20 HB2 PHE 20 -4.267 -7.772 -1.650 152 HB3 PHE 20 HB1 PHE 20 -3.580 -6.387 -0.818 153 HD1 PHE 20 HD1 PHE 20 -2.529 -9.267 -1.084 154 HD2 PHE 20 HD2 PHE 20 -4.631 -7.239 1.985 155 HE1 PHE 20 HE1 PHE 20 -1.540 -10.780 0.547 156 HE2 PHE 20 HE2 PHE 20 -3.662 -8.776 3.654 157 HZ PHE 20 HZ PHE 20 -2.112 -10.557 2.929 158 H LYS 21 HN LYS 21 -6.659 -7.656 -2.475 159 HA LYS 21 HA LYS 21 -6.687 -5.545 -4.257 160 HB2 LYS 21 HB2 LYS 21 -7.401 -7.971 -4.587 161 HB3 LYS 21 HB1 LYS 21 -8.971 -7.504 -3.964 162 HG2 LYS 21 HG2 LYS 21 -7.619 -6.606 -6.497 163 HG3 LYS 21 HG1 LYS 21 -9.124 -7.486 -6.322 164 HD2 LYS 21 HD2 LYS 21 -8.794 -4.670 -5.359 165 HD3 LYS 21 HD1 LYS 21 -9.297 -5.070 -6.995 166 HE2 LYS 21 HE2 LYS 21 -10.684 -5.674 -4.410 167 HE3 LYS 21 HE1 LYS 21 -11.261 -4.722 -5.762 168 HZ1 LYS 21 HZ1 LYS 21 -12.346 -6.862 -5.704 169 HZ2 LYS 21 HZ2 LYS 21 -10.863 -7.660 -5.773 170 HZ3 LYS 21 HZ3 LYS 21 -11.392 -6.746 -7.094 171 H ALA 22 HN ALA 22 -9.180 -6.443 -1.892 172 HA ALA 22 HA ALA 22 -10.998 -4.489 -2.677 173 HB1 ALA 22 HB1 ALA 22 -12.116 -4.908 -0.574 174 HB2 ALA 22 HB2 ALA 22 -10.684 -5.737 0.036 175 HB3 ALA 22 HB3 ALA 22 -11.589 -6.418 -1.316 176 H ALA 23 HN ALA 23 -8.322 -4.366 -0.402 177 HA ALA 23 HA ALA 23 -8.897 -1.845 0.714 178 HB1 ALA 23 HB1 ALA 23 -6.193 -3.115 0.241 179 HB2 ALA 23 HB2 ALA 23 -7.186 -3.297 1.686 180 HB3 ALA 23 HB3 ALA 23 -6.508 -1.720 1.278 181 H PHE 24 HN PHE 24 -6.778 -2.768 -1.993 182 HA PHE 24 HA PHE 24 -6.082 -0.324 -3.030 183 HB2 PHE 24 HB2 PHE 24 -5.367 -2.439 -4.049 184 HB3 PHE 24 HB1 PHE 24 -7.009 -2.777 -4.482 185 HD1 PHE 24 HD1 PHE 24 -7.208 -2.783 -6.772 186 HD2 PHE 24 HD2 PHE 24 -4.986 0.316 -4.874 187 HE1 PHE 24 HE1 PHE 24 -7.015 -1.603 -8.918 188 HE2 PHE 24 HE2 PHE 24 -4.789 1.491 -7.014 189 HZ PHE 24 HZ PHE 24 -5.805 0.537 -9.039 190 H ASP 25 HN ASP 25 -8.715 -2.290 -4.020 191 HA ASP 25 HA ASP 25 -10.192 -0.757 -5.686 192 HB2 ASP 25 HB2 ASP 25 -10.700 -3.101 -4.970 193 HB3 ASP 25 HB1 ASP 25 -11.369 -2.450 -3.501 194 H ILE 26 HN ILE 26 -10.836 -0.860 -2.183 195 HA ILE 26 HA ILE 26 -12.793 1.202 -2.311 196 HB ILE 26 HB ILE 26 -11.286 0.151 0.010 197 HG12 ILE 26 HG12 ILE 26 -14.004 -0.759 -0.841 198 HG13 ILE 26 HG11 ILE 26 -12.541 -1.502 -1.466 199 HG21 ILE 26 HG21 ILE 26 -13.114 0.926 1.404 200 HG22 ILE 26 HG22 ILE 26 -13.994 1.480 -0.020 201 HG23 ILE 26 HG23 ILE 26 -12.490 2.276 0.453 202 HD11 ILE 26 HD11 ILE 26 -13.134 -1.337 1.458 203 HD12 ILE 26 HD12 ILE 26 -11.918 -2.319 0.630 204 HD13 ILE 26 HD13 ILE 26 -13.632 -2.685 0.437 205 H PHE 27 HN PHE 27 -9.344 1.135 -1.556 206 HA PHE 27 HA PHE 27 -8.839 3.730 -0.711 207 HB2 PHE 27 HB2 PHE 27 -7.390 1.615 -2.072 208 HB3 PHE 27 HB1 PHE 27 -6.917 3.185 -2.658 209 HD1 PHE 27 HD1 PHE 27 -6.753 0.817 -0.015 210 HD2 PHE 27 HD2 PHE 27 -5.856 4.804 -1.125 211 HE1 PHE 27 HE1 PHE 27 -5.153 0.962 1.844 212 HE2 PHE 27 HE2 PHE 27 -4.320 4.943 0.730 213 HZ PHE 27 HZ PHE 27 -3.930 3.056 2.220 214 H VAL 28 HN VAL 28 -9.516 2.429 -3.887 215 HA VAL 28 HA VAL 28 -9.204 5.072 -5.099 216 HB VAL 28 HB VAL 28 -9.027 3.877 -7.256 217 HG11 VAL 28 HG11 VAL 28 -6.830 3.165 -6.949 218 HG12 VAL 28 HG12 VAL 28 -7.183 2.524 -5.346 219 HG13 VAL 28 HG13 VAL 28 -7.094 4.268 -5.593 220 HG21 VAL 28 HG21 VAL 28 -10.414 1.933 -6.824 221 HG22 VAL 28 HG22 VAL 28 -9.318 1.393 -5.550 222 HG23 VAL 28 HG23 VAL 28 -8.787 1.393 -7.229 223 H LEU 29 HN LEU 29 -11.549 3.497 -3.729 224 HA LEU 29 HA LEU 29 -13.525 3.171 -5.759 225 HB2 LEU 29 HB2 LEU 29 -13.398 1.736 -3.881 226 HB3 LEU 29 HB1 LEU 29 -13.491 3.069 -2.763 227 HG LEU 29 HG LEU 29 -15.872 3.010 -4.341 228 HD11 LEU 29 HD11 LEU 29 -15.132 0.439 -2.933 229 HD12 LEU 29 HD12 LEU 29 -15.297 0.634 -4.681 230 HD13 LEU 29 HD13 LEU 29 -16.711 0.813 -3.639 231 HD21 LEU 29 HD21 LEU 29 -15.662 4.040 -2.160 232 HD22 LEU 29 HD22 LEU 29 -15.213 2.489 -1.445 233 HD23 LEU 29 HD23 LEU 29 -16.844 2.735 -2.077 234 H GLY 30 HN GLY 30 -14.641 4.747 -6.634 235 HA2 GLY 30 HA2 GLY 30 -15.944 6.727 -6.633 236 HA3 GLY 30 HA1 GLY 30 -15.173 7.207 -5.128 237 H ALA 31 HN ALA 31 -12.679 6.089 -6.832 238 HA ALA 31 HA ALA 31 -11.729 8.694 -7.566 239 HB1 ALA 31 HB1 ALA 31 -10.171 7.004 -6.710 240 HB2 ALA 31 HB2 ALA 31 -9.699 7.551 -8.320 241 HB3 ALA 31 HB3 ALA 31 -10.491 5.988 -8.120 242 H GLU 32 HN GLU 32 -10.946 9.273 -9.636 243 HA GLU 32 HA GLU 32 -12.877 8.780 -11.689 244 HB2 GLU 32 HB2 GLU 32 -10.243 10.250 -11.756 245 HB3 GLU 32 HB1 GLU 32 -11.476 10.315 -13.009 246 HG2 GLU 32 HG2 GLU 32 -13.047 11.288 -11.390 247 HG3 GLU 32 HG1 GLU 32 -11.772 11.278 -10.173 248 H ASP 33 HN ASP 33 -9.517 7.918 -11.132 249 HA ASP 33 HA ASP 33 -9.429 6.528 -13.696 250 HB2 ASP 33 HB2 ASP 33 -6.945 6.527 -13.251 251 HB3 ASP 33 HB1 ASP 33 -7.668 8.096 -13.530 252 H GLY 34 HN GLY 34 -9.686 5.868 -10.394 253 HA2 GLY 34 HA2 GLY 34 -9.811 3.903 -9.244 254 HA3 GLY 34 HA1 GLY 34 -9.730 3.090 -10.789 255 H SER 35 HN SER 35 -7.269 5.282 -9.795 256 HA SER 35 HA SER 35 -5.476 3.065 -9.013 257 HB2 SER 35 HB2 SER 35 -3.621 4.345 -10.103 258 HB3 SER 35 HB1 SER 35 -4.804 3.725 -11.235 259 HG SER 35 HG SER 35 -5.672 6.102 -10.571 260 H ILE 36 HN ILE 36 -4.029 3.688 -7.277 261 HA ILE 36 HA ILE 36 -5.198 5.684 -5.579 262 HB ILE 36 HB ILE 36 -2.848 3.835 -5.302 263 HG12 ILE 36 HG12 ILE 36 -5.280 4.242 -3.559 264 HG13 ILE 36 HG11 ILE 36 -5.156 3.029 -4.835 265 HG21 ILE 36 HG21 ILE 36 -2.729 6.362 -4.278 266 HG22 ILE 36 HG22 ILE 36 -1.871 4.976 -3.637 267 HG23 ILE 36 HG23 ILE 36 -3.406 5.469 -2.916 268 HD11 ILE 36 HD11 ILE 36 -3.534 1.817 -3.670 269 HD12 ILE 36 HD12 ILE 36 -4.735 2.268 -2.458 270 HD13 ILE 36 HD13 ILE 36 -3.209 3.150 -2.566 271 H SER 37 HN SER 37 -4.885 7.722 -6.240 272 HA SER 37 HA SER 37 -2.218 8.662 -6.877 273 HB2 SER 37 HB2 SER 37 -3.320 10.822 -7.190 274 HB3 SER 37 HB1 SER 37 -4.221 9.569 -8.028 275 HG SER 37 HG SER 37 -5.884 9.966 -6.801 276 H THR 38 HN THR 38 -1.719 10.849 -5.515 277 HA THR 38 HA THR 38 -0.967 9.687 -3.091 278 HB THR 38 HB THR 38 -0.159 11.949 -2.472 279 HG1 THR 38 HG1 THR 38 -0.750 12.749 -5.124 280 HG21 THR 38 HG21 THR 38 1.524 11.942 -4.335 281 HG22 THR 38 HG22 THR 38 0.528 10.731 -5.145 282 HG23 THR 38 HG23 THR 38 1.259 10.369 -3.577 283 H LYS 39 HN LYS 39 -3.537 12.041 -3.754 284 HA LYS 39 HA LYS 39 -4.138 12.196 -0.947 285 HB2 LYS 39 HB2 LYS 39 -4.655 13.832 -3.055 286 HB3 LYS 39 HB1 LYS 39 -6.222 13.117 -2.717 287 HG2 LYS 39 HG2 LYS 39 -4.443 14.429 -0.676 288 HG3 LYS 39 HG1 LYS 39 -5.801 15.187 -1.471 289 HD2 LYS 39 HD2 LYS 39 -7.365 13.809 -0.389 290 HD3 LYS 39 HD1 LYS 39 -6.117 12.663 0.100 291 HE2 LYS 39 HE2 LYS 39 -6.903 14.061 1.973 292 HE3 LYS 39 HE1 LYS 39 -5.182 14.268 1.649 293 HZ1 LYS 39 HZ1 LYS 39 -5.664 16.320 0.492 294 HZ2 LYS 39 HZ2 LYS 39 -6.337 16.387 2.039 295 HZ3 LYS 39 HZ3 LYS 39 -7.326 16.104 0.700 296 H GLU 40 HN GLU 40 -5.166 10.243 -3.661 297 HA GLU 40 HA GLU 40 -7.407 9.004 -2.511 298 HB2 GLU 40 HB2 GLU 40 -5.503 8.394 -4.644 299 HB3 GLU 40 HB1 GLU 40 -5.993 6.946 -3.780 300 HG2 GLU 40 HG2 GLU 40 -7.380 7.448 -5.764 301 HG3 GLU 40 HG1 GLU 40 -8.295 7.347 -4.262 302 H LEU 41 HN LEU 41 -3.972 8.354 -2.269 303 HA LEU 41 HA LEU 41 -4.131 6.267 -0.374 304 HB2 LEU 41 HB2 LEU 41 -2.150 7.074 -1.899 305 HB3 LEU 41 HB1 LEU 41 -1.840 8.198 -0.656 306 HG LEU 41 HG LEU 41 -0.387 6.626 -0.003 307 HD11 LEU 41 HD11 LEU 41 -1.449 4.926 1.539 308 HD12 LEU 41 HD12 LEU 41 -2.957 5.718 1.128 309 HD13 LEU 41 HD13 LEU 41 -1.704 6.625 1.910 310 HD21 LEU 41 HD21 LEU 41 -1.314 5.144 -1.970 311 HD22 LEU 41 HD22 LEU 41 -2.000 4.253 -0.616 312 HD23 LEU 41 HD23 LEU 41 -0.264 4.516 -0.714 313 H GLY 42 HN GLY 42 -3.433 9.741 -0.076 314 HA2 GLY 42 HA2 GLY 42 -3.066 10.003 2.633 315 HA3 GLY 42 HA1 GLY 42 -3.693 11.261 1.590 316 H LYS 43 HN LYS 43 -6.093 9.986 0.851 317 HA LYS 43 HA LYS 43 -7.892 10.725 2.829 318 HB2 LYS 43 HB2 LYS 43 -8.666 10.534 0.617 319 HB3 LYS 43 HB1 LYS 43 -8.029 8.919 0.428 320 HG2 LYS 43 HG2 LYS 43 -9.874 8.499 2.359 321 HG3 LYS 43 HG1 LYS 43 -10.609 9.834 1.462 322 HD2 LYS 43 HD2 LYS 43 -10.513 8.632 -0.583 323 HD3 LYS 43 HD1 LYS 43 -9.487 7.387 0.118 324 HE2 LYS 43 HE2 LYS 43 -11.713 6.525 -0.115 325 HE3 LYS 43 HE1 LYS 43 -11.361 6.733 1.599 326 HZ1 LYS 43 HZ1 LYS 43 -12.950 8.602 -0.075 327 HZ2 LYS 43 HZ2 LYS 43 -12.626 8.785 1.568 328 HZ3 LYS 43 HZ3 LYS 43 -13.578 7.500 1.038 329 H VAL 44 HN VAL 44 -6.698 7.478 2.011 330 HA VAL 44 HA VAL 44 -8.041 6.195 4.156 331 HB VAL 44 HB VAL 44 -5.760 5.325 2.388 332 HG11 VAL 44 HG11 VAL 44 -5.714 4.193 4.669 333 HG12 VAL 44 HG12 VAL 44 -5.970 3.092 3.315 334 HG13 VAL 44 HG13 VAL 44 -7.334 3.576 4.325 335 HG21 VAL 44 HG21 VAL 44 -7.545 3.992 1.360 336 HG22 VAL 44 HG22 VAL 44 -7.939 5.712 1.349 337 HG23 VAL 44 HG23 VAL 44 -8.701 4.644 2.531 338 H MET 45 HN MET 45 -4.854 7.557 3.699 339 HA MET 45 HA MET 45 -3.671 6.667 6.050 340 HB2 MET 45 HB2 MET 45 -3.310 9.374 4.789 341 HB3 MET 45 HB1 MET 45 -2.181 8.544 5.854 342 HG2 MET 45 HG2 MET 45 -3.035 7.237 3.353 343 HG3 MET 45 HG1 MET 45 -1.845 8.505 3.292 344 HE1 MET 45 HE1 MET 45 0.501 8.372 3.974 345 HE2 MET 45 HE2 MET 45 1.140 7.213 5.142 346 HE3 MET 45 HE3 MET 45 -0.101 8.366 5.632 347 H ARG 46 HN ARG 46 -5.755 9.509 5.472 348 HA ARG 46 HA ARG 46 -5.733 10.363 8.172 349 HB2 ARG 46 HB2 ARG 46 -7.155 11.041 5.698 350 HB3 ARG 46 HB1 ARG 46 -8.039 11.343 7.173 351 HG2 ARG 46 HG2 ARG 46 -6.900 13.336 6.793 352 HG3 ARG 46 HG1 ARG 46 -5.942 12.527 7.996 353 HD2 ARG 46 HD2 ARG 46 -4.289 11.983 6.466 354 HD3 ARG 46 HD1 ARG 46 -5.309 12.295 5.075 355 HE ARG 46 HE ARG 46 -4.798 14.560 6.823 356 HH11 ARG 46 HH11 ARG 46 -3.966 12.923 3.841 357 HH12 ARG 46 HH12 ARG 46 -3.103 14.283 3.196 358 HH21 ARG 46 HH21 ARG 46 -3.686 16.341 5.972 359 HH22 ARG 46 HH22 ARG 46 -2.932 16.218 4.414 360 H MET 47 HN MET 47 -7.540 8.019 6.379 361 HA MET 47 HA MET 47 -9.579 7.496 8.227 362 HB2 MET 47 HB2 MET 47 -8.258 6.158 5.926 363 HB3 MET 47 HB1 MET 47 -9.411 5.266 6.855 364 HG2 MET 47 HG2 MET 47 -11.144 6.844 6.339 365 HG3 MET 47 HG1 MET 47 -9.974 7.902 5.561 366 HE1 MET 47 HE1 MET 47 -11.784 4.478 5.455 367 HE2 MET 47 HE2 MET 47 -10.134 3.943 5.156 368 HE3 MET 47 HE3 MET 47 -11.335 3.832 3.876 369 H LEU 48 HN LEU 48 -6.233 6.997 8.291 370 HA LEU 48 HA LEU 48 -6.348 4.742 10.172 371 HB2 LEU 48 HB2 LEU 48 -3.941 5.826 8.794 372 HB3 LEU 48 HB1 LEU 48 -4.074 4.302 9.633 373 HG LEU 48 HG LEU 48 -5.471 5.020 7.069 374 HD11 LEU 48 HD11 LEU 48 -3.983 3.375 6.070 375 HD12 LEU 48 HD12 LEU 48 -3.124 3.225 7.600 376 HD13 LEU 48 HD13 LEU 48 -3.109 4.756 6.721 377 HD21 LEU 48 HD21 LEU 48 -6.760 3.483 8.461 378 HD22 LEU 48 HD22 LEU 48 -5.366 2.401 8.551 379 HD23 LEU 48 HD23 LEU 48 -6.154 2.712 7.002 380 H GLY 49 HN GLY 49 -6.171 8.047 10.289 381 HA2 GLY 49 HA2 GLY 49 -5.725 9.280 12.280 382 HA3 GLY 49 HA1 GLY 49 -4.625 8.005 12.784 383 H GLN 50 HN GLN 50 -3.959 8.396 9.680 384 HA GLN 50 HA GLN 50 -1.552 9.904 10.144 385 HB2 GLN 50 HB2 GLN 50 -2.729 8.685 7.642 386 HB3 GLN 50 HB1 GLN 50 -1.106 9.342 7.752 387 HG2 GLN 50 HG2 GLN 50 -2.229 6.892 9.131 388 HG3 GLN 50 HG1 GLN 50 -0.968 6.941 7.899 389 HE21 GLN 50 HE21 GLN 50 1.109 7.277 8.510 390 HE22 GLN 50 HE22 GLN 50 1.609 7.444 10.153 391 H ASN 51 HN ASN 51 -0.984 11.851 8.884 392 HA ASN 51 HA ASN 51 -3.173 13.056 7.349 393 HB2 ASN 51 HB2 ASN 51 -2.694 15.309 8.393 394 HB3 ASN 51 HB1 ASN 51 -3.518 14.156 9.432 395 HD21 ASN 51 HD21 ASN 51 -0.649 15.990 8.901 396 HD22 ASN 51 HD22 ASN 51 0.106 15.638 10.415 397 HA PRO 52 HA PRO 52 1.150 13.056 5.393 398 HB2 PRO 52 HB2 PRO 52 -0.040 12.406 2.953 399 HB3 PRO 52 HB1 PRO 52 0.883 11.353 3.991 400 HG2 PRO 52 HG2 PRO 52 -2.030 11.561 3.629 401 HG3 PRO 52 HG1 PRO 52 -1.070 10.187 4.186 402 HD2 PRO 52 HD2 PRO 52 -2.630 11.654 5.812 403 HD3 PRO 52 HD1 PRO 52 -1.205 10.829 6.348 404 H THR 53 HN THR 53 1.997 14.275 3.712 405 HA THR 53 HA THR 53 0.173 16.129 2.371 406 HB THR 53 HB THR 53 2.355 17.198 1.540 407 HG1 THR 53 HG1 THR 53 3.757 16.335 3.723 408 HG21 THR 53 HG21 THR 53 1.023 18.285 3.255 409 HG22 THR 53 HG22 THR 53 2.740 18.463 3.613 410 HG23 THR 53 HG23 THR 53 1.771 17.285 4.499 411 HA PRO 54 HA PRO 54 0.418 13.862 -1.452 412 HB2 PRO 54 HB2 PRO 54 0.949 16.553 -2.585 413 HB3 PRO 54 HB1 PRO 54 -0.169 15.310 -3.142 414 HG2 PRO 54 HG2 PRO 54 -1.102 17.331 -1.808 415 HG3 PRO 54 HG1 PRO 54 -1.641 15.718 -1.393 416 HD2 PRO 54 HD2 PRO 54 0.337 17.466 0.006 417 HD3 PRO 54 HD1 PRO 54 -0.947 16.450 0.696 418 H GLU 55 HN GLU 55 2.831 16.162 -0.480 419 HA GLU 55 HA GLU 55 4.920 15.589 -2.215 420 HB2 GLU 55 HB2 GLU 55 4.803 16.532 0.585 421 HB3 GLU 55 HB1 GLU 55 6.340 16.188 -0.154 422 HG2 GLU 55 HG2 GLU 55 6.070 18.395 -0.539 423 HG3 GLU 55 HG1 GLU 55 5.499 17.652 -1.995 424 H GLU 56 HN GLU 56 4.231 14.124 0.975 425 HA GLU 56 HA GLU 56 6.371 12.233 0.648 426 HB2 GLU 56 HB2 GLU 56 5.470 11.295 2.806 427 HB3 GLU 56 HB1 GLU 56 5.998 12.957 2.872 428 HG2 GLU 56 HG2 GLU 56 3.637 13.607 2.619 429 HG3 GLU 56 HG1 GLU 56 3.186 11.915 2.762 430 H LEU 57 HN LEU 57 2.890 12.219 0.372 431 HA LEU 57 HA LEU 57 2.455 9.460 0.119 432 HB2 LEU 57 HB2 LEU 57 0.964 11.771 -1.114 433 HB3 LEU 57 HB1 LEU 57 0.404 10.135 -1.100 434 HG LEU 57 HG LEU 57 1.031 11.478 1.486 435 HD11 LEU 57 HD11 LEU 57 -0.443 13.063 0.467 436 HD12 LEU 57 HD12 LEU 57 -1.415 12.072 1.563 437 HD13 LEU 57 HD13 LEU 57 -1.469 11.775 -0.172 438 HD21 LEU 57 HD21 LEU 57 -0.589 9.890 2.286 439 HD22 LEU 57 HD22 LEU 57 0.617 9.047 1.319 440 HD23 LEU 57 HD23 LEU 57 -0.970 9.407 0.639 441 H GLN 58 HN GLN 58 3.704 11.824 -2.141 442 HA GLN 58 HA GLN 58 3.138 10.343 -4.504 443 HB2 GLN 58 HB2 GLN 58 3.621 12.778 -4.501 444 HB3 GLN 58 HB1 GLN 58 5.288 12.429 -4.061 445 HG2 GLN 58 HG2 GLN 58 5.452 11.071 -6.159 446 HG3 GLN 58 HG1 GLN 58 3.874 11.708 -6.614 447 HE21 GLN 58 HE21 GLN 58 7.230 12.388 -6.202 448 HE22 GLN 58 HE22 GLN 58 7.219 13.950 -6.944 449 H GLU 59 HN GLU 59 5.988 10.663 -2.448 450 HA GLU 59 HA GLU 59 7.628 9.035 -4.070 451 HB2 GLU 59 HB2 GLU 59 7.969 9.609 -1.184 452 HB3 GLU 59 HB1 GLU 59 9.223 9.205 -2.331 453 HG2 GLU 59 HG2 GLU 59 8.952 11.291 -3.460 454 HG3 GLU 59 HG1 GLU 59 7.530 11.680 -2.501 455 H MET 60 HN MET 60 5.639 8.379 -1.217 456 HA MET 60 HA MET 60 6.394 5.661 -0.938 457 HB2 MET 60 HB2 MET 60 4.406 5.414 0.442 458 HB3 MET 60 HB1 MET 60 5.280 6.879 0.856 459 HG2 MET 60 HG2 MET 60 3.639 8.027 -0.774 460 HG3 MET 60 HG1 MET 60 2.674 6.570 -0.555 461 HE1 MET 60 HE1 MET 60 1.014 6.873 2.656 462 HE2 MET 60 HE2 MET 60 2.158 5.679 2.065 463 HE3 MET 60 HE3 MET 60 0.991 6.404 0.961 464 H ILE 61 HN ILE 61 3.806 7.207 -2.808 465 HA ILE 61 HA ILE 61 2.731 4.785 -3.836 466 HB ILE 61 HB ILE 61 2.606 7.641 -4.775 467 HG12 ILE 61 HG12 ILE 61 0.695 5.772 -3.382 468 HG13 ILE 61 HG11 ILE 61 1.412 7.254 -2.755 469 HG21 ILE 61 HG21 ILE 61 1.083 5.318 -5.956 470 HG22 ILE 61 HG22 ILE 61 2.445 6.139 -6.718 471 HG23 ILE 61 HG23 ILE 61 0.951 7.021 -6.410 472 HD11 ILE 61 HD11 ILE 61 -0.677 6.987 -4.893 473 HD12 ILE 61 HD12 ILE 61 0.155 8.499 -4.508 474 HD13 ILE 61 HD13 ILE 61 -0.842 7.711 -3.287 475 H ASP 62 HN ASP 62 5.131 7.107 -4.976 476 HA ASP 62 HA ASP 62 5.673 6.023 -7.484 477 HB2 ASP 62 HB2 ASP 62 6.469 8.222 -6.646 478 HB3 ASP 62 HB1 ASP 62 7.598 7.390 -5.594 479 H GLU 63 HN GLU 63 6.637 5.038 -4.327 480 HA GLU 63 HA GLU 63 8.744 3.278 -4.855 481 HB2 GLU 63 HB2 GLU 63 8.070 3.966 -2.613 482 HB3 GLU 63 HB1 GLU 63 6.551 3.097 -2.790 483 HG2 GLU 63 HG2 GLU 63 7.663 1.498 -1.700 484 HG3 GLU 63 HG1 GLU 63 8.272 1.116 -3.297 485 H VAL 64 HN VAL 64 5.247 2.772 -4.854 486 HA VAL 64 HA VAL 64 5.619 0.021 -5.762 487 HB VAL 64 HB VAL 64 2.989 0.087 -5.508 488 HG11 VAL 64 HG11 VAL 64 3.281 -0.561 -3.131 489 HG12 VAL 64 HG12 VAL 64 4.955 -0.008 -3.223 490 HG13 VAL 64 HG13 VAL 64 4.420 -1.365 -4.215 491 HG21 VAL 64 HG21 VAL 64 2.864 2.469 -5.071 492 HG22 VAL 64 HG22 VAL 64 3.917 2.289 -3.674 493 HG23 VAL 64 HG23 VAL 64 2.323 1.545 -3.672 494 H ASP 65 HN ASP 65 4.293 3.085 -6.776 495 HA ASP 65 HA ASP 65 3.118 2.387 -9.221 496 HB2 ASP 65 HB2 ASP 65 2.849 4.615 -8.217 497 HB3 ASP 65 HB1 ASP 65 4.577 4.892 -8.382 498 H GLU 66 HN GLU 66 4.267 1.134 -10.672 499 HA GLU 66 HA GLU 66 7.062 1.685 -11.062 500 HB2 GLU 66 HB2 GLU 66 5.162 -0.371 -12.104 501 HB3 GLU 66 HB1 GLU 66 6.762 -0.196 -12.739 502 HG2 GLU 66 HG2 GLU 66 7.641 -0.492 -10.425 503 HG3 GLU 66 HG1 GLU 66 5.998 -0.905 -9.971 504 H ASP 67 HN ASP 67 4.114 2.762 -12.377 505 HA ASP 67 HA ASP 67 5.164 3.200 -15.050 506 HB2 ASP 67 HB2 ASP 67 2.789 2.588 -14.739 507 HB3 ASP 67 HB1 ASP 67 2.528 4.075 -13.839 508 H GLY 68 HN GLY 68 5.371 4.777 -12.124 509 HA2 GLY 68 HA2 GLY 68 6.201 6.831 -11.523 510 HA3 GLY 68 HA1 GLY 68 6.699 7.029 -13.195 511 H SER 69 HN SER 69 3.395 6.451 -12.306 512 HA SER 69 HA SER 69 2.595 8.963 -13.554 513 HB2 SER 69 HB2 SER 69 1.534 6.773 -14.166 514 HB3 SER 69 HB1 SER 69 0.886 6.683 -12.534 515 HG SER 69 HG SER 69 0.337 9.064 -13.721 516 H GLY 70 HN GLY 70 2.939 7.575 -10.422 517 HA2 GLY 70 HA2 GLY 70 2.661 8.685 -8.375 518 HA3 GLY 70 HA1 GLY 70 1.743 9.937 -9.195 519 H THR 71 HN THR 71 0.765 6.881 -10.107 520 HA THR 71 HA THR 71 -1.294 6.762 -8.024 521 HB THR 71 HB THR 71 -2.892 5.967 -9.783 522 HG1 THR 71 HG1 THR 71 -1.116 5.495 -11.315 523 HG21 THR 71 HG21 THR 71 -1.904 8.745 -10.396 524 HG22 THR 71 HG22 THR 71 -2.926 8.334 -9.017 525 HG23 THR 71 HG23 THR 71 -3.526 8.090 -10.662 526 H VAL 72 HN VAL 72 -1.710 4.748 -7.225 527 HA VAL 72 HA VAL 72 -0.122 2.567 -8.364 528 HB VAL 72 HB VAL 72 -1.110 3.116 -5.641 529 HG11 VAL 72 HG11 VAL 72 -2.511 1.109 -6.381 530 HG12 VAL 72 HG12 VAL 72 -1.411 0.807 -5.039 531 HG13 VAL 72 HG13 VAL 72 -0.977 0.249 -6.649 532 HG21 VAL 72 HG21 VAL 72 0.946 2.257 -5.078 533 HG22 VAL 72 HG22 VAL 72 1.286 2.830 -6.712 534 HG23 VAL 72 HG23 VAL 72 0.957 1.114 -6.417 535 H ASP 73 HN ASP 73 -0.930 0.829 -9.291 536 HA ASP 73 HA ASP 73 -3.847 0.488 -9.127 537 HB2 ASP 73 HB2 ASP 73 -3.836 0.374 -11.343 538 HB3 ASP 73 HB1 ASP 73 -2.099 0.478 -11.381 539 H PHE 74 HN PHE 74 -4.074 -2.230 -9.736 540 HA PHE 74 HA PHE 74 -4.108 -3.024 -7.097 541 HB2 PHE 74 HB2 PHE 74 -5.528 -4.010 -8.767 542 HB3 PHE 74 HB1 PHE 74 -4.163 -4.772 -9.538 543 HD1 PHE 74 HD1 PHE 74 -5.233 -6.954 -9.329 544 HD2 PHE 74 HD2 PHE 74 -4.280 -4.615 -5.903 545 HE1 PHE 74 HE1 PHE 74 -5.489 -8.935 -7.909 546 HE2 PHE 74 HE2 PHE 74 -4.561 -6.602 -4.471 547 HZ PHE 74 HZ PHE 74 -5.142 -8.764 -5.478 548 H ASP 75 HN ASP 75 -2.090 -4.728 -9.496 549 HA ASP 75 HA ASP 75 -0.763 -6.252 -7.594 550 HB2 ASP 75 HB2 ASP 75 0.592 -7.042 -9.283 551 HB3 ASP 75 HB1 ASP 75 -0.836 -6.541 -10.154 552 H GLU 76 HN GLU 76 -0.194 -3.015 -8.588 553 HA GLU 76 HA GLU 76 2.390 -2.571 -7.564 554 HB2 GLU 76 HB2 GLU 76 0.087 -0.758 -7.818 555 HB3 GLU 76 HB1 GLU 76 1.742 -0.232 -7.670 556 HG2 GLU 76 HG2 GLU 76 2.100 -1.715 -9.770 557 HG3 GLU 76 HG1 GLU 76 0.363 -1.588 -9.923 558 H PHE 77 HN PHE 77 -0.693 -1.676 -6.250 559 HA PHE 77 HA PHE 77 0.015 -1.030 -3.660 560 HB2 PHE 77 HB2 PHE 77 -2.238 -0.651 -4.492 561 HB3 PHE 77 HB1 PHE 77 -2.492 -2.375 -4.716 562 HD1 PHE 77 HD1 PHE 77 -2.261 0.349 -2.303 563 HD2 PHE 77 HD2 PHE 77 -3.062 -3.776 -2.884 564 HE1 PHE 77 HE1 PHE 77 -3.241 0.234 -0.057 565 HE2 PHE 77 HE2 PHE 77 -4.042 -3.912 -0.634 566 HZ PHE 77 HZ PHE 77 -4.138 -1.897 0.781 567 H LEU 78 HN LEU 78 -0.650 -4.108 -5.130 568 HA LEU 78 HA LEU 78 -0.915 -5.593 -2.801 569 HB2 LEU 78 HB2 LEU 78 -1.741 -6.153 -5.051 570 HB3 LEU 78 HB1 LEU 78 -0.116 -6.568 -5.489 571 HG LEU 78 HG LEU 78 -0.125 -8.521 -4.306 572 HD11 LEU 78 HD11 LEU 78 -0.536 -7.596 -2.143 573 HD12 LEU 78 HD12 LEU 78 -1.628 -8.945 -2.426 574 HD13 LEU 78 HD13 LEU 78 -2.227 -7.291 -2.549 575 HD21 LEU 78 HD21 LEU 78 -1.819 -8.782 -5.972 576 HD22 LEU 78 HD22 LEU 78 -3.013 -7.983 -4.943 577 HD23 LEU 78 HD23 LEU 78 -2.378 -9.556 -4.489 578 H VAL 79 HN VAL 79 1.988 -4.700 -4.551 579 HA VAL 79 HA VAL 79 3.603 -6.606 -3.184 580 HB VAL 79 HB VAL 79 4.152 -4.377 -5.081 581 HG11 VAL 79 HG11 VAL 79 6.283 -5.497 -3.223 582 HG12 VAL 79 HG12 VAL 79 5.742 -3.820 -3.264 583 HG13 VAL 79 HG13 VAL 79 6.598 -4.510 -4.644 584 HG21 VAL 79 HG21 VAL 79 5.219 -7.180 -4.728 585 HG22 VAL 79 HG22 VAL 79 5.512 -6.124 -6.116 586 HG23 VAL 79 HG23 VAL 79 3.874 -6.702 -5.779 587 H MET 80 HN MET 80 3.094 -3.079 -2.646 588 HA MET 80 HA MET 80 4.912 -3.104 -0.473 589 HB2 MET 80 HB2 MET 80 4.293 -0.999 -1.545 590 HB3 MET 80 HB1 MET 80 2.641 -1.178 -0.969 591 HG2 MET 80 HG2 MET 80 3.840 0.365 0.437 592 HG3 MET 80 HG1 MET 80 3.477 -1.101 1.345 593 HE1 MET 80 HE1 MET 80 6.776 -0.687 3.087 594 HE2 MET 80 HE2 MET 80 5.208 -1.489 3.141 595 HE3 MET 80 HE3 MET 80 5.296 0.260 2.945 596 H MET 81 HN MET 81 1.577 -3.879 -0.870 597 HA MET 81 HA MET 81 0.684 -4.099 1.758 598 HB2 MET 81 HB2 MET 81 -0.566 -4.488 -0.382 599 HB3 MET 81 HB1 MET 81 0.190 -6.045 -0.441 600 HG2 MET 81 HG2 MET 81 -1.788 -5.047 1.565 601 HG3 MET 81 HG1 MET 81 -2.012 -6.309 0.361 602 HE1 MET 81 HE1 MET 81 -0.594 -5.222 3.691 603 HE2 MET 81 HE2 MET 81 -0.781 -6.742 4.583 604 HE3 MET 81 HE3 MET 81 -2.179 -5.996 3.794 605 H VAL 82 HN VAL 82 2.040 -6.607 -0.298 606 HA VAL 82 HA VAL 82 2.462 -8.438 1.774 607 HB VAL 82 HB VAL 82 2.348 -8.975 -0.693 608 HG11 VAL 82 HG11 VAL 82 4.477 -9.053 -1.851 609 HG12 VAL 82 HG12 VAL 82 5.219 -8.246 -0.459 610 HG13 VAL 82 HG13 VAL 82 4.001 -7.408 -1.414 611 HG21 VAL 82 HG21 VAL 82 4.679 -10.285 0.665 612 HG22 VAL 82 HG22 VAL 82 3.467 -11.006 -0.412 613 HG23 VAL 82 HG23 VAL 82 3.026 -10.527 1.235 614 H ARG 83 HN ARG 83 4.425 -5.898 0.481 615 HA ARG 83 HA ARG 83 6.908 -6.521 1.637 616 HB2 ARG 83 HB2 ARG 83 6.290 -4.802 -0.157 617 HB3 ARG 83 HB1 ARG 83 5.834 -3.766 1.174 618 HG2 ARG 83 HG2 ARG 83 8.069 -3.646 1.963 619 HG3 ARG 83 HG1 ARG 83 8.589 -4.902 0.838 620 HD2 ARG 83 HD2 ARG 83 7.931 -3.441 -1.041 621 HD3 ARG 83 HD1 ARG 83 7.530 -2.175 0.114 622 HE ARG 83 HE ARG 83 10.268 -3.260 -0.140 623 HH11 ARG 83 HH11 ARG 83 8.035 -0.563 0.050 624 HH12 ARG 83 HH12 ARG 83 9.275 0.644 -0.155 625 HH21 ARG 83 HH21 ARG 83 11.898 -1.675 -0.373 626 HH22 ARG 83 HH22 ARG 83 11.470 0.006 -0.366 627 H SER 84 HN SER 84 4.084 -4.823 2.873 628 HA SER 84 HA SER 84 5.438 -3.783 5.168 629 HB2 SER 84 HB2 SER 84 3.478 -2.652 4.110 630 HB3 SER 84 HB1 SER 84 2.453 -3.978 4.658 631 HG SER 84 HG SER 84 3.496 -3.352 6.824 632 H MET 85 HN MET 85 3.274 -6.519 4.550 633 HA MET 85 HA MET 85 3.209 -7.158 7.383 634 HB2 MET 85 HB2 MET 85 1.549 -8.825 6.821 635 HB3 MET 85 HB1 MET 85 1.146 -7.303 6.059 636 HG2 MET 85 HG2 MET 85 1.722 -8.034 3.960 637 HG3 MET 85 HG1 MET 85 2.683 -9.366 4.588 638 HE1 MET 85 HE1 MET 85 1.679 -10.860 2.846 639 HE2 MET 85 HE2 MET 85 0.571 -9.630 2.218 640 HE3 MET 85 HE3 MET 85 -0.041 -11.226 2.652 641 H LYS 86 HN LYS 86 4.600 -8.469 4.417 642 HA LYS 86 HA LYS 86 5.339 -10.952 5.684 643 HB2 LYS 86 HB2 LYS 86 5.057 -10.014 3.017 644 HB3 LYS 86 HB1 LYS 86 6.693 -10.597 3.238 645 HG2 LYS 86 HG2 LYS 86 4.325 -12.232 4.008 646 HG3 LYS 86 HG1 LYS 86 5.018 -12.252 2.384 647 HD2 LYS 86 HD2 LYS 86 7.223 -12.784 3.430 648 HD3 LYS 86 HD1 LYS 86 6.383 -12.977 4.966 649 HE2 LYS 86 HE2 LYS 86 5.849 -14.555 2.452 650 HE3 LYS 86 HE1 LYS 86 6.756 -15.127 3.851 651 HZ1 LYS 86 HZ1 LYS 86 3.890 -14.353 3.841 652 HZ2 LYS 86 HZ2 LYS 86 4.754 -14.863 5.197 653 HZ3 LYS 86 HZ3 LYS 86 4.486 -15.932 3.914 654 H ASP 87 HN ASP 87 6.425 -8.392 6.697 655 HA ASP 87 HA ASP 87 9.061 -7.956 5.893 656 HB2 ASP 87 HB2 ASP 87 8.002 -6.262 7.174 657 HB3 ASP 87 HB1 ASP 87 7.602 -7.385 8.470 658 H ASP 88 HN ASP 88 10.883 -9.017 6.211 659 HA ASP 88 HA ASP 88 10.896 -11.508 7.645 660 HB2 ASP 88 HB2 ASP 88 13.084 -9.993 6.214 661 HB3 ASP 88 HB1 ASP 88 13.309 -11.570 6.959 662 H SER 89 HN SER 89 11.626 -8.270 8.337 663 HA SER 89 HA SER 89 12.537 -7.149 10.056 664 HB2 SER 89 HB2 SER 89 12.389 -9.770 11.560 665 HB3 SER 89 HB1 SER 89 12.591 -8.168 12.272 666 HG SER 89 HG SER 89 10.463 -8.029 10.719 667 H LYS 90 HN LYS 90 14.077 -10.168 11.015 668 HA LYS 90 HA LYS 90 16.268 -10.694 11.343 669 HB2 LYS 90 HB2 LYS 90 15.816 -11.168 8.915 670 HB3 LYS 90 HB1 LYS 90 16.567 -9.625 8.543 671 HG2 LYS 90 HG2 LYS 90 18.096 -11.501 8.237 672 HG3 LYS 90 HG1 LYS 90 18.665 -10.381 9.476 673 HD2 LYS 90 HD2 LYS 90 17.880 -11.862 11.222 674 HD3 LYS 90 HD1 LYS 90 17.172 -12.942 10.023 675 HE2 LYS 90 HE2 LYS 90 19.384 -13.422 9.137 676 HE3 LYS 90 HE1 LYS 90 20.105 -12.310 10.298 677 HZ1 LYS 90 HZ1 LYS 90 19.341 -13.718 12.092 678 HZ2 LYS 90 HZ2 LYS 90 20.280 -14.620 11.017 679 HZ3 LYS 90 HZ3 LYS 90 18.596 -14.773 11.000 680 H GLY 136 HN GLY 136 16.509 -8.965 12.936 681 HA2 GLY 136 HA2 GLY 136 18.124 -7.470 13.780 682 HA3 GLY 136 HA1 GLY 136 18.588 -7.073 12.129 683 H LYS 137 HN LYS 137 15.965 -6.614 11.151 684 HA LYS 137 HA LYS 137 15.415 -4.009 12.371 685 HB2 LYS 137 HB2 LYS 137 14.374 -5.217 9.808 686 HB3 LYS 137 HB1 LYS 137 14.092 -3.576 10.364 687 HG2 LYS 137 HG2 LYS 137 16.441 -3.053 10.131 688 HG3 LYS 137 HG1 LYS 137 16.791 -4.722 9.676 689 HD2 LYS 137 HD2 LYS 137 15.332 -4.462 7.704 690 HD3 LYS 137 HD1 LYS 137 15.058 -2.778 8.153 691 HE2 LYS 137 HE2 LYS 137 17.436 -2.307 7.897 692 HE3 LYS 137 HE1 LYS 137 17.741 -3.997 7.501 693 HZ1 LYS 137 HZ1 LYS 137 16.431 -3.763 5.513 694 HZ2 LYS 137 HZ2 LYS 137 17.626 -2.569 5.529 695 HZ3 LYS 137 HZ3 LYS 137 16.029 -2.169 5.905 696 H PHE 138 HN PHE 138 12.852 -3.628 11.671 697 HA PHE 138 HA PHE 138 11.131 -5.819 12.306 698 HB2 PHE 138 HB2 PHE 138 11.832 -5.212 14.563 699 HB3 PHE 138 HB1 PHE 138 11.414 -3.529 14.267 700 HD1 PHE 138 HD1 PHE 138 9.420 -2.785 15.073 701 HD2 PHE 138 HD2 PHE 138 9.816 -6.897 14.066 702 HE1 PHE 138 HE1 PHE 138 7.129 -3.191 15.873 703 HE2 PHE 138 HE2 PHE 138 7.522 -7.316 14.868 704 HZ PHE 138 HZ PHE 138 6.179 -5.461 15.777 705 H LYS 139 HN LYS 139 9.697 -5.497 10.737 706 HA LYS 139 HA LYS 139 8.379 -4.486 9.181 707 HB2 LYS 139 HB2 LYS 139 8.004 -2.199 11.116 708 HB3 LYS 139 HB1 LYS 139 6.880 -2.787 9.903 709 HG2 LYS 139 HG2 LYS 139 6.510 -4.809 11.219 710 HG3 LYS 139 HG1 LYS 139 7.652 -4.226 12.435 711 HD2 LYS 139 HD2 LYS 139 5.584 -3.611 13.317 712 HD3 LYS 139 HD1 LYS 139 6.143 -2.134 12.529 713 HE2 LYS 139 HE2 LYS 139 3.904 -2.332 11.877 714 HE3 LYS 139 HE1 LYS 139 4.819 -2.926 10.492 715 HZ1 LYS 139 HZ1 LYS 139 4.440 -5.201 11.336 716 HZ2 LYS 139 HZ2 LYS 139 3.012 -4.405 10.918 717 HZ3 LYS 139 HZ3 LYS 139 3.440 -4.568 12.546 718 H ARG 140 HN ARG 140 10.506 -4.192 8.089 719 HA ARG 140 HA ARG 140 12.302 -2.209 8.619 720 HB2 ARG 140 HB2 ARG 140 13.025 -2.477 6.191 721 HB3 ARG 140 HB1 ARG 140 13.114 -3.852 7.273 722 HG2 ARG 140 HG2 ARG 140 12.170 -4.910 5.521 723 HG3 ARG 140 HG1 ARG 140 10.689 -4.299 6.246 724 HD2 ARG 140 HD2 ARG 140 10.674 -3.898 3.859 725 HD3 ARG 140 HD1 ARG 140 10.768 -2.360 4.722 726 HE ARG 140 HE ARG 140 13.218 -2.440 4.215 727 HH11 ARG 140 HH11 ARG 140 10.961 -4.188 2.174 728 HH12 ARG 140 HH12 ARG 140 11.973 -4.112 0.763 729 HH21 ARG 140 HH21 ARG 140 14.557 -2.366 2.381 730 HH22 ARG 140 HH22 ARG 140 14.024 -3.080 0.893 731 HA PRO 141 HA PRO 141 10.623 1.619 7.484 732 HB2 PRO 141 HB2 PRO 141 13.260 2.747 7.679 733 HB3 PRO 141 HB1 PRO 141 11.956 2.836 8.859 734 HG2 PRO 141 HG2 PRO 141 14.312 1.417 9.180 735 HG3 PRO 141 HG1 PRO 141 12.844 1.193 10.123 736 HD2 PRO 141 HD2 PRO 141 13.975 -0.405 7.911 737 HD3 PRO 141 HD1 PRO 141 12.974 -0.886 9.278 738 H THR 142 HN THR 142 10.326 2.549 5.536 739 HA THR 142 HA THR 142 12.407 2.084 3.531 740 HB THR 142 HB THR 142 10.426 1.679 1.907 741 HG1 THR 142 HG1 THR 142 8.542 1.604 2.824 742 HG21 THR 142 HG21 THR 142 10.423 -0.734 2.413 743 HG22 THR 142 HG22 THR 142 11.210 -0.392 3.955 744 HG23 THR 142 HG23 THR 142 12.046 -0.045 2.441 745 H LEU 143 HN LEU 143 9.901 4.140 4.779 746 HA LEU 143 HA LEU 143 10.344 6.051 2.636 747 HB2 LEU 143 HB2 LEU 143 7.735 4.710 3.207 748 HB3 LEU 143 HB1 LEU 143 7.824 6.253 2.374 749 HG LEU 143 HG LEU 143 9.427 3.928 1.378 750 HD11 LEU 143 HD11 LEU 143 7.265 2.976 1.518 751 HD12 LEU 143 HD12 LEU 143 7.528 3.443 -0.162 752 HD13 LEU 143 HD13 LEU 143 6.513 4.439 0.881 753 HD21 LEU 143 HD21 LEU 143 8.211 6.370 0.105 754 HD22 LEU 143 HD22 LEU 143 9.031 5.089 -0.787 755 HD23 LEU 143 HD23 LEU 143 9.922 6.054 0.391 756 H ARG 144 HN ARG 144 8.455 7.829 3.023 757 HA ARG 144 HA ARG 144 9.455 9.510 4.933 758 HB2 ARG 144 HB2 ARG 144 6.741 9.525 3.625 759 HB3 ARG 144 HB1 ARG 144 7.390 10.863 4.560 760 HG2 ARG 144 HG2 ARG 144 8.732 9.732 2.118 761 HG3 ARG 144 HG1 ARG 144 7.617 11.098 2.091 762 HD2 ARG 144 HD2 ARG 144 9.095 12.313 3.634 763 HD3 ARG 144 HD1 ARG 144 10.220 10.954 3.611 764 HE ARG 144 HE ARG 144 9.679 11.857 0.974 765 HH11 ARG 144 HH11 ARG 144 11.428 12.811 3.863 766 HH12 ARG 144 HH12 ARG 144 12.673 13.637 2.985 767 HH21 ARG 144 HH21 ARG 144 11.303 12.934 -0.172 768 HH22 ARG 144 HH22 ARG 144 12.604 13.706 0.685 769 H ARG 145 HN ARG 145 7.892 10.752 6.470 770 HA ARG 145 HA ARG 145 7.977 9.429 8.865 771 HB2 ARG 145 HB2 ARG 145 7.693 11.926 8.342 772 HB3 ARG 145 HB1 ARG 145 5.969 11.592 8.316 773 HG2 ARG 145 HG2 ARG 145 7.719 10.941 10.657 774 HG3 ARG 145 HG1 ARG 145 6.890 12.487 10.473 775 HD2 ARG 145 HD2 ARG 145 4.754 11.242 10.324 776 HD3 ARG 145 HD1 ARG 145 5.650 9.761 10.661 777 HE ARG 145 HE ARG 145 6.229 11.612 12.678 778 HH11 ARG 145 HH11 ARG 145 3.536 9.707 11.523 779 HH12 ARG 145 HH12 ARG 145 2.757 9.632 13.067 780 HH21 ARG 145 HH21 ARG 145 5.217 11.496 14.729 781 HH22 ARG 145 HH22 ARG 145 3.713 10.646 14.893 782 H VAL 146 HN VAL 146 5.011 9.960 6.913 783 HA VAL 146 HA VAL 146 3.358 8.551 8.705 784 HB VAL 146 HB VAL 146 1.820 8.314 6.637 785 HG11 VAL 146 HG11 VAL 146 1.093 10.623 6.913 786 HG12 VAL 146 HG12 VAL 146 2.626 11.022 7.691 787 HG13 VAL 146 HG13 VAL 146 1.507 9.899 8.467 788 HG21 VAL 146 HG21 VAL 146 2.274 9.669 4.779 789 HG22 VAL 146 HG22 VAL 146 3.766 8.766 5.071 790 HG23 VAL 146 HG23 VAL 146 3.634 10.449 5.570 791 H ARG 147 HN ARG 147 3.969 6.585 9.284 792 HA ARG 147 HA ARG 147 4.323 4.607 7.149 793 HB2 ARG 147 HB2 ARG 147 6.259 4.855 8.643 794 HB3 ARG 147 HB1 ARG 147 5.239 4.490 10.027 795 HG2 ARG 147 HG2 ARG 147 6.643 2.600 9.236 796 HG3 ARG 147 HG1 ARG 147 4.916 2.255 9.308 797 HD2 ARG 147 HD2 ARG 147 4.738 2.628 6.880 798 HD3 ARG 147 HD1 ARG 147 6.462 2.964 6.810 799 HE ARG 147 HE ARG 147 5.331 0.359 7.631 800 HH11 ARG 147 HH11 ARG 147 7.770 2.235 5.952 801 HH12 ARG 147 HH12 ARG 147 8.711 0.844 5.513 802 HH21 ARG 147 HH21 ARG 147 6.592 -1.460 7.096 803 HH22 ARG 147 HH22 ARG 147 8.066 -1.253 6.202 804 H ILE 148 HN ILE 148 3.591 2.339 7.947 805 HA ILE 148 HA ILE 148 0.950 2.519 9.120 806 HB ILE 148 HB ILE 148 1.555 2.392 6.238 807 HG12 ILE 148 HG12 ILE 148 -1.015 3.243 7.552 808 HG13 ILE 148 HG11 ILE 148 0.409 4.244 7.600 809 HG21 ILE 148 HG21 ILE 148 -0.383 1.103 5.633 810 HG22 ILE 148 HG22 ILE 148 -0.767 0.845 7.340 811 HG23 ILE 148 HG23 ILE 148 0.690 0.132 6.650 812 HD11 ILE 148 HD11 ILE 148 -1.028 4.888 5.779 813 HD12 ILE 148 HD12 ILE 148 -0.921 3.246 5.125 814 HD13 ILE 148 HD13 ILE 148 0.518 4.263 5.199 815 H SER 149 HN SER 149 0.326 0.681 9.965 816 HA SER 149 HA SER 149 1.873 -1.725 9.682 817 HB2 SER 149 HB2 SER 149 -0.595 -0.928 11.215 818 HB3 SER 149 HB1 SER 149 -0.046 -2.597 11.173 819 HG SER 149 HG SER 149 1.654 -0.449 11.900 820 H ALA 150 HN ALA 150 1.442 -3.339 8.266 821 HA ALA 150 HA ALA 150 0.110 -2.970 5.931 822 HB1 ALA 150 HB1 ALA 150 0.248 -5.342 5.562 823 HB2 ALA 150 HB2 ALA 150 0.370 -5.646 7.294 824 HB3 ALA 150 HB3 ALA 150 1.681 -4.822 6.448 825 H ASP 151 HN ASP 151 -1.164 -4.849 8.644 826 HA ASP 151 HA ASP 151 -3.702 -5.407 7.649 827 HB2 ASP 151 HB2 ASP 151 -3.073 -4.861 10.546 828 HB3 ASP 151 HB1 ASP 151 -4.303 -5.937 9.898 829 H ALA 152 HN ALA 152 -2.503 -2.715 9.531 830 HA ALA 152 HA ALA 152 -4.890 -1.550 10.314 831 HB1 ALA 152 HB1 ALA 152 -2.378 -0.022 9.729 832 HB2 ALA 152 HB2 ALA 152 -2.546 -1.096 11.117 833 HB3 ALA 152 HB3 ALA 152 -3.610 0.300 10.954 834 H MET 153 HN MET 153 -2.873 -0.795 7.476 835 HA MET 153 HA MET 153 -4.436 1.437 6.691 836 HB2 MET 153 HB2 MET 153 -2.110 1.126 6.031 837 HB3 MET 153 HB1 MET 153 -2.577 -0.189 4.968 838 HG2 MET 153 HG2 MET 153 -4.165 1.628 3.935 839 HG3 MET 153 HG1 MET 153 -3.039 2.743 4.706 840 HE1 MET 153 HE1 MET 153 -3.463 -0.109 2.111 841 HE2 MET 153 HE2 MET 153 -2.221 -0.769 3.176 842 HE3 MET 153 HE3 MET 153 -1.818 -0.327 1.514 843 H MET 154 HN MET 154 -4.314 -1.923 5.467 844 HA MET 154 HA MET 154 -6.363 -1.573 3.555 845 HB2 MET 154 HB2 MET 154 -6.712 -4.108 3.861 846 HB3 MET 154 HB1 MET 154 -5.172 -3.562 3.228 847 HG2 MET 154 HG2 MET 154 -4.273 -3.747 5.563 848 HG3 MET 154 HG1 MET 154 -5.799 -4.517 6.006 849 HE1 MET 154 HE1 MET 154 -5.715 -7.860 4.023 850 HE2 MET 154 HE2 MET 154 -6.551 -6.367 3.585 851 HE3 MET 154 HE3 MET 154 -6.529 -6.910 5.266 852 H GLN 155 HN GLN 155 -6.411 -2.426 6.960 853 HA GLN 155 HA GLN 155 -9.051 -3.261 7.205 854 HB2 GLN 155 HB2 GLN 155 -7.110 -1.971 9.089 855 HB3 GLN 155 HB1 GLN 155 -8.786 -2.185 9.589 856 HG2 GLN 155 HG2 GLN 155 -8.607 -4.579 9.153 857 HG3 GLN 155 HG1 GLN 155 -6.911 -4.369 8.710 858 HE21 GLN 155 HE21 GLN 155 -8.457 -2.572 11.258 859 HE22 GLN 155 HE22 GLN 155 -7.589 -3.291 12.566 860 H ALA 156 HN ALA 156 -7.735 -0.044 6.966 861 HA ALA 156 HA ALA 156 -9.889 1.507 7.733 862 HB1 ALA 156 HB1 ALA 156 -8.342 2.975 7.147 863 HB2 ALA 156 HB2 ALA 156 -8.869 2.758 5.480 864 HB3 ALA 156 HB3 ALA 156 -7.535 1.806 6.113 865 H LEU 157 HN LEU 157 -9.221 0.132 4.487 866 HA LEU 157 HA LEU 157 -11.885 0.796 3.612 867 HB2 LEU 157 HB2 LEU 157 -10.325 -1.158 2.093 868 HB3 LEU 157 HB1 LEU 157 -11.420 0.063 1.604 869 HG LEU 157 HG LEU 157 -9.304 0.572 0.739 870 HD11 LEU 157 HD11 LEU 157 -10.715 2.401 1.452 871 HD12 LEU 157 HD12 LEU 157 -8.989 2.761 1.494 872 HD13 LEU 157 HD13 LEU 157 -9.854 2.418 2.995 873 HD21 LEU 157 HD21 LEU 157 -7.350 0.926 1.927 874 HD22 LEU 157 HD22 LEU 157 -8.006 -0.589 2.567 875 HD23 LEU 157 HD23 LEU 157 -8.203 0.912 3.479 876 H LEU 158 HN LEU 158 -10.242 -1.910 4.971 877 HA LEU 158 HA LEU 158 -11.863 -3.896 3.707 878 HB2 LEU 158 HB2 LEU 158 -9.362 -3.892 4.748 879 HB3 LEU 158 HB1 LEU 158 -10.226 -4.682 6.022 880 HG LEU 158 HG LEU 158 -11.103 -6.189 4.111 881 HD11 LEU 158 HD11 LEU 158 -8.598 -5.047 2.972 882 HD12 LEU 158 HD12 LEU 158 -10.234 -4.838 2.337 883 HD13 LEU 158 HD13 LEU 158 -9.485 -6.449 2.324 884 HD21 LEU 158 HD21 LEU 158 -8.257 -6.345 5.009 885 HD22 LEU 158 HD22 LEU 158 -9.228 -7.671 4.391 886 HD23 LEU 158 HD23 LEU 158 -9.631 -6.931 5.927 887 H GLY 159 HN GLY 159 -12.607 -1.912 6.264 888 HA2 GLY 159 HA2 GLY 159 -13.815 -3.783 8.032 889 HA3 GLY 159 HA1 GLY 159 -14.230 -2.080 7.907 890 H ALA 160 HN ALA 160 -14.802 -5.268 6.647 891 HA ALA 160 HA ALA 160 -17.430 -4.972 5.805 892 HB1 ALA 160 HB1 ALA 160 -15.428 -4.561 3.583 893 HB2 ALA 160 HB2 ALA 160 -16.561 -3.354 4.197 894 HB3 ALA 160 HB3 ALA 160 -17.163 -4.788 3.374 895 H ARG 161 HN ARG 161 -14.294 -6.410 5.375 896 HA ARG 161 HA ARG 161 -15.485 -9.064 5.322 897 HB2 ARG 161 HB2 ARG 161 -14.112 -9.730 3.351 898 HB3 ARG 161 HB1 ARG 161 -15.364 -8.560 2.960 899 HG2 ARG 161 HG2 ARG 161 -13.749 -6.771 2.938 900 HG3 ARG 161 HG1 ARG 161 -12.469 -7.888 3.430 901 HD2 ARG 161 HD2 ARG 161 -12.269 -7.594 1.074 902 HD3 ARG 161 HD1 ARG 161 -12.938 -9.201 1.348 903 HE ARG 161 HE ARG 161 -14.834 -7.051 0.823 904 HH11 ARG 161 HH11 ARG 161 -13.117 -9.873 -0.369 905 HH12 ARG 161 HH12 ARG 161 -14.102 -10.016 -1.788 906 HH21 ARG 161 HH21 ARG 161 -16.129 -7.262 -1.036 907 HH22 ARG 161 HH22 ARG 161 -15.828 -8.550 -2.156 908 H ALA 162 HN ALA 162 -13.653 -7.248 6.965 909 HA ALA 162 HA ALA 162 -11.177 -8.797 6.928 910 HB1 ALA 162 HB1 ALA 162 -11.059 -6.329 6.914 911 HB2 ALA 162 HB2 ALA 162 -10.229 -7.062 8.289 912 HB3 ALA 162 HB3 ALA 162 -11.812 -6.308 8.507 913 H LYS 163 HN LYS 163 -12.165 -10.695 7.850 914 HA LYS 163 HA LYS 163 -13.204 -10.789 10.464 915 HB2 LYS 163 HB2 LYS 163 -12.940 -13.119 10.365 916 HB3 LYS 163 HB1 LYS 163 -13.183 -12.655 8.692 917 HG2 LYS 163 HG2 LYS 163 -10.528 -13.235 9.983 918 HG3 LYS 163 HG1 LYS 163 -11.441 -14.353 8.973 919 HD2 LYS 163 HD2 LYS 163 -10.823 -13.325 7.061 920 HD3 LYS 163 HD1 LYS 163 -10.903 -11.714 7.781 921 HE2 LYS 163 HE2 LYS 163 -8.810 -12.075 8.916 922 HE3 LYS 163 HE1 LYS 163 -8.729 -13.726 8.293 923 HZ1 LYS 163 HZ1 LYS 163 -8.705 -12.723 6.020 924 HZ2 LYS 163 HZ2 LYS 163 -7.339 -12.382 6.950 925 HZ3 LYS 163 HZ3 LYS 163 -8.532 -11.203 6.743 926 H GLY 164 HN GLY 164 -12.106 -11.656 12.404 927 HA2 GLY 164 HA2 GLY 164 -9.205 -11.291 12.422 928 HA3 GLY 164 HA1 GLY 164 -10.154 -10.267 13.492 929 H HIS 165 HN HIS 165 -9.270 -13.578 12.746 930 HA HIS 165 HA HIS 165 -10.398 -14.514 15.277 931 HB2 HIS 165 HB2 HIS 165 -10.788 -15.796 13.167 932 HB3 HIS 165 HB1 HIS 165 -9.059 -16.097 13.073 933 HD1 HIS 165 HD1 HIS 165 -8.316 -18.229 14.087 934 HD2 HIS 165 HD2 HIS 165 -11.927 -16.921 15.678 935 HE1 HIS 165 HE1 HIS 165 -9.058 -20.043 15.654 936 HE2 HIS 165 HE2 HIS 165 -11.321 -19.305 16.479 937 HAB 9XG 201 HAB DRG 201 6.201 3.272 4.736 938 HAC 9XG 201 HAC DRG 201 6.804 2.565 3.220 939 HAA 9XG 201 HAA DRG 201 5.940 1.544 4.392 940 HAD 9XG 201 HAD DRG 201 -1.110 1.825 -2.631 941 HAE 9XG 201 HAE DRG 201 -0.521 0.326 -0.743 942 HAF 9XG 201 HAF DRG 201 0.399 3.692 -3.251 943 HAG 9XG 201 HAG DRG 201 1.768 4.237 3.992 944 HAH 9XG 201 HAH DRG 201 3.917 3.702 5.105 945 HAI 9XG 201 HAI DRG 201 1.561 0.715 0.544 946 HAJ 9XG 201 HAJ DRG 201 2.474 4.087 -1.955 947 HAK 9XG 201 HAK DRG 201 1.458 3.722 1.585 948 HAL 9XG 201 HAL DRG 201 5.410 2.059 1.425 949 HAM 9XG 201 HAM DRG 201 4.110 2.618 -0.480
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